SCHEMBL3679226

SCHEMBL3679226

Cc1cnc(C)c(O)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
ALDH1A1 P00352 5/20 0.43
HPGD P15428 3/20 0.43
HSD17B10 Q99714 1/20 0.43
CCR1 P32246 1/20 0.41
CCR5 P51681 1/20 0.41
CCR8 P51685 1/20 0.41
LMNA P02545 3/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
PDXK O00764 1/20 0.38
AOX1 Q06278 1/20 0.38
TRIM24 O15164 1/20 0.37
TRIM33 Q9UPN9 1/20 0.37
VRK1 Q99986 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
P2RX3 P56373 1/20 0.34
TNF P01375 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31184201 1.00 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10CCR1
SCHEMBL9656230 0.81 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10CCR1
SCHEMBL9332858 0.79 ALDH1A1 (0.39) KDM4EALDH1A1HPGDHSD17B10CCR1
SCHEMBL2260982 0.79 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10LMNA
Methane SCHEMBL6846367 0.77 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL25035025 0.75 VRK1 (0.41) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL11707220 0.75 NOS3 (0.43) KDM4EALDH1A1CCR1CCR5CCR8
SCHEMBL9164063 0.75 CCR1 (0.38) CCR1CCR5CCR8NOS3NOS1
SCHEMBL874915 0.75 CCR1 (0.46) CCR1CCR5CCR8NOS3NOS1
SCHEMBL4321859 0.73 KDM4E (0.39) KDM4EALDH1A1HPGDHSD17B10LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 69 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12552790-B2 Positive modulators of the muscarinic acetylcholine receptor M4 VANDERBILT UNIVERSITY (US) 2026-02-17 US disclosed
US-20260035366-A1 POSITIVE MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 UNIV VANDERBILT (US) 2026-02-05 US disclosed
US-12448380-B2 Positive modulators of the muscarinic acetylcholine receptor M4 VANDERBILT UNIVERSITY (US) 2025-10-21 US disclosed
US-12398117-B2 Heteroarylamidopyridinol derivative and pharmaceutical composition comprising same as active ingredient for prevention or treatment of autoimmune disease INNOVO THERAPEUTICS INC. (KR) 2025-08-26 US disclosed
US-20250228811-A1 Triester Compounds And Methods Of Use Thereof LIFEMINE THERAPEUTICS, INC. 2025-07-17 US disclosed
US-12344608-B2 Positive modulators of the muscarinic acetylcholine receptor M4 VANDERBILT UNIVERSITY (US) 2025-07-01 US disclosed
WO-2025137071-A2 TRIESTER COMPOUNDS AND METHODS OF USE THEREOF LIFEMINE THERAPEUTICS, INC. (US) 2025-06-26 WO disclosed
US-20250136600-A1 POSITIVE MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 VANDERBILT UNIVERSITY 2025-05-01 US disclosed
US-20250122199-A1 POSITIVE MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 VANDERBILT UNIVERSITY 2025-04-17 US disclosed
US-20250122200-A1 POSITIVE MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 VANDERBILT UNIVERSITY 2025-04-17 US disclosed
WO-2014171801-A1 AMIDOPYRIDINOL DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE COMPONENT 영남대학교 산학협력단 (KR) 2014-10-23 WO disclosed
WO-2014086704-A1 SUBSTITUTED ISOXAZOLE AMIDE COMPOUNDS AS INHIBITORS OF STEAROYL-COA DESATURASE 1 (SCD1) F. HOFFMANN-LA ROCHE AG (CH) 2014-06-12 WO disclosed
WO-2013095060-A1 6-AMINOPYRIDINE-3-OL DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENTS FOR PREVENTING OR TREATING DISEASES CAUSED BY ANGIOGENESIS 영남대학교 산학협력단 (KR) 2013-06-27 WO disclosed
WO-2013095060-A1 6-AMINOPYRIDINE-3-OL DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENTS FOR PREVENTING OR TREATING DISEASES CAUSED BY ANGIOGENESIS 영남대학교 산학협력단 (KR) 2013-06-27 WO disclosed
WO-2013019874-A9 VITAMIN B6 DERIVATIVES OF NUCLEOTIDES, ACYCLONUCLEOTIDES AND ACYCLONUCLEOSIDE PHOSPHONATES MBC PHARMA, INC. (US) 2013-04-11 WO disclosed
WO-2013019874-A1 VITAMIN B6 DERIVATIVES OF NUCLEOTIDES, ACYCLONUCLEOTIDES AND ACYCLONUCLEOSIDE PHOSPHONATES MBC PHARMA, INC. (US) 2013-02-07 WO disclosed
EP-2231604-A1 PREPARATIONS CONTAINING PYRIDOXINE AND ALPHA-HYDROXYISOCAPROIC ACID (HICA) Northern Innovations and Formulations Corp. (CA) 2010-09-29 EP disclosed
WO-2009073943-A1 PREPARATIONS CONTAINING PYRIDOXINE AND ALPHA-HYDROXYISOCAPROIC ACID (HICA) IOVATE T. & P. INC. (CA) 2009-06-18 WO disclosed
US-20090156647-A1 Method for maintaining physiological pH levels during intensive physical exercise IOVATE T. & P. INC. (CA) 2009-06-18 US disclosed
US-20090156648-A1 Preparations containing pyridoxine and alpha-hydroxyisocaproic acid (HICA) IOVATE T. & P. INC. (CA) 2009-06-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250122200-A1 POSITIVE MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM4, CHRM1, CHRM3 KDM4E 753/4885ALDH1A1 2993/4885HPGD 1730/4885
US-12552790-B2 Positive modulators of the muscarinic acetylcholine receptor M4 CHRM4, CHRM1, CHRM5 KDM4E 437/4885ALDH1A1 2392/4885HPGD 3652/4885
US-20250136600-A1 POSITIVE MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM4, CHRM1, CHRM3 KDM4E 753/4885ALDH1A1 2993/4885HPGD 1730/4885
US-12398117-B2 Heteroarylamidopyridinol derivative and pharmaceutical composition comprising same as active ingredient for prevention or treatment of autoimmune disease IL6, TRAF6, CD14 KDM4E 978/4885ALDH1A1 1799/4885HPGD 586/4885
US-20250228811-A1 Triester Compounds And Methods Of Use Thereof CYP46A1, CYP17A1, CYP27A1 KDM4E 2546/4885ALDH1A1 1167/4885HPGD 815/4885
US-12344608-B2 Positive modulators of the muscarinic acetylcholine receptor M4 CHRM4, CHRM1, CHRM3 KDM4E 753/4885ALDH1A1 2993/4885HPGD 1730/4885
US-20090156648-A1 Preparations containing pyridoxine and alpha-hydroxyisocaproic acid (HICA) PNPO, CYP3A5, CYP8B1 KDM4E 1424/4885ALDH1A1 871/4885HPGD 17/4885
US-20250122199-A1 POSITIVE MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM4, CHRM1, CHRM3 KDM4E 753/4885ALDH1A1 2993/4885HPGD 1730/4885
US-20260035366-A1 POSITIVE MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM4, CHRM3, CHRM5 KDM4E 775/4885ALDH1A1 3334/4885HPGD 1698/4885
US-12448380-B2 Positive modulators of the muscarinic acetylcholine receptor M4 CHRM4, CHRM1, CHRM3 KDM4E 753/4885ALDH1A1 2993/4885HPGD 1730/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.