SCHEMBL8014381

SCHEMBL8014381

CC(C)C(=O)N1CCCCCC1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
HTT P42858 1/20 0.46
CHRNB2 P17787 1/20 0.45
CHRNA3 P32297 1/20 0.45
CHRNA4 P43681 1/20 0.45
CHRNB3 Q05901 1/20 0.45
CHRNA6 Q15825 1/20 0.45
MMP1 P03956 2/20 0.44
MMP2 P08253 2/20 0.44
MMP8 P22894 1/20 0.44
HPGD P15428 3/20 0.43
DPP7 Q9UHL4 1/20 0.41
MMP3 P08254 1/20 0.41
MMP9 P14780 1/20 0.41
DPP4 P27487 1/20 0.41
CA2 P00918 1/20 0.39
CHKA P35790 1/20 0.39

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
SCHEMBL10223269 1.00 ALDH1A1 (0.48) ALDH1A1HTTCHRNB2CHRNA3CHRNA4
SCHEMBL25447805 1.00 ALDH1A1 (0.48) ALDH1A1HTTCHRNB2CHRNA3CHRNA4
SCHEMBL1140476 1.00 ALDH1A1 (0.48) ALDH1A1HTTCHRNB2CHRNA3CHRNA4
SCHEMBL21455835 1.00 ALDH1A1 (0.48) ALDH1A1HTTCHRNB2CHRNA3CHRNA4
SCHEMBL7246527 1.00 ALDH1A1 (0.48) ALDH1A1HTTCHRNB2CHRNA3CHRNA4
SCHEMBL1106510 0.97 CHRNB2 (0.46) ALDH1A1HTTCHRNB2CHRNA3CHRNA4
SCHEMBL4546653 0.92
SCHEMBL22753493 0.86 CHRNB2 (0.50) ALDH1A1CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL4546617 0.86 CHRNB2 (0.50) ALDH1A1CHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL674660 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018115-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE LOXO ONCOLOGY, INC. 2024-01-18 US disclosed
US-20230145481-A1 SUBSTITUTED BENZENECARBOXAMIDES AS IL-17A MODULATORS DICE ALPHA, INC. 2023-05-11 US disclosed
US-20230070613-A1 PROTEIN TYROSINE KINASE 6 (PTK6) DEGRADATION / DISRUPTION COMPOUNDS AND METHODS OF USE ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI 2023-03-09 US disclosed
US-10961256-B2 PRMT5 inhibitors CTXT PTY LTD (AU) 2021-03-30 US disclosed
EP-3189042-B1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS CTXT PTY LTD (AU) 2021-03-17 EP disclosed
US-10766863-B2 Monocarboxylate transport modulators and uses thereof NIROGYONE THERAPEUTICS, INC. (US) 2020-09-08 US disclosed
US-10752610-B2 Pharmaceutical compounds HEPTARES THERAPEUTICS LIMITED (GB) 2020-08-25 US disclosed
US-10669258-B2 3-sulfonyl-5-aminopyridine-2,4-diol APJ agonists BRISTOL-MYERS SQUIBB COMPANY (US) 2020-06-02 US disclosed
US-10550096-B2 Tetrahydroisoquinolines as PRMT5 inhibitors CTXT PTY LTD (AU) 2020-02-04 US disclosed
WO-2019243851-A1 BRIDGED COMPOUNDS AS AGONISTS OF THE MUSCARINIC M1 AND/OR M4 RECEPTOR HEPTARES THERAPEUTICS LIMITED (GB) 2019-12-26 WO disclosed
US-20120022069-A1 ACRYLAMIDE COMPOUNDS AND THE USE THEREOF SHIONOGI & CO., LTD. (JP) 2012-01-26 US disclosed
US-7897601-B2 Cannabinoid receptor modulators INTERVET, INC. (US) 2011-03-01 US disclosed
US-20090191153-A1 OXIMYL MACROCYCLIC DERIVATIVES ENANTA PHARMACEUTICALS, INC. 2009-07-30 US disclosed
US-20090191153-A1 OXIMYL MACROCYCLIC DERIVATIVES ENANTA PHARMACEUTICALS, INC. 2009-07-30 US disclosed
US-20090156800-A1 PROCESS FOR MAKING MACROCYCLIC OXIMYL HEPATITIS C PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. 2009-06-18 US disclosed
WO-2009073713-A1 OXIMYL MACROCYCLIC DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2009-06-11 WO disclosed
US-20080146546-A1 Bicyclic and Tricyclic Heteroaromatic Compounds NEUROGEN CORPORATION 2008-06-19 US disclosed
US-20080146546-A1 Bicyclic and Tricyclic Heteroaromatic Compounds NEUROGEN CORPORATION 2008-06-19 US disclosed
US-7326709-B2 Bicyclic and tricyclic heteroaromatic compounds NEUROGEN CORPORATION (US) 2008-02-05 US disclosed
US-20070197628-A1 Cannabinoid receptor modulators INTERVET INTERNATIONAL B.V. (NL) 2007-08-23 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 (13 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-20120022069-A1 ACRYLAMIDE COMPOUNDS AND THE USE THEREOF TRPA1, TRPV1, CACNA1B ALDH1A1 809/4885HTT 382/4885CHRNB2 373/4885
US-20080146546-A1 Bicyclic and Tricyclic Heteroaromatic Compounds GABBR1, GABBR2, GABRA4 ALDH1A1 1142/4885HTT 2776/4885CHRNB2 108/4885
US-20240018115-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PIK3CA, PIK3R4, PIK3R5 ALDH1A1 3412/4885HTT 1751/4885CHRNB2 1046/4885
US-20230145481-A1 SUBSTITUTED BENZENECARBOXAMIDES AS IL-17A MODULATORS IL17A, IL2, IL23R ALDH1A1 372/4885HTT 4589/4885CHRNB2 4733/4885
US-10766863-B2 Monocarboxylate transport modulators and uses thereof SLC16A1, SLC16A3, SLC16A7 ALDH1A1 521/4885HTT 1880/4885CHRNB2 4644/4885
US-20230070613-A1 PROTEIN TYROSINE KINASE 6 (PTK6) DEGRADATION / DISRUPTION COMPOUNDS AND METHODS OF USE PTK6, NEK6, GRK6 ALDH1A1 4782/4885HTT 1508/4885CHRNB2 4326/4885
US-20070197628-A1 Cannabinoid receptor modulators CNR1, CNR2, GPR18 ALDH1A1 1999/4885HTT 2641/4885CHRNB2 659/4885
US-10961256-B2 PRMT5 inhibitors PRMT5, PRMT1, PRMT3 ALDH1A1 4022/4885HTT 2139/4885CHRNB2 2501/4885
US-10550096-B2 Tetrahydroisoquinolines as PRMT5 inhibitors PRMT5, PRMT1, PRMT3 ALDH1A1 4296/4885HTT 1632/4885CHRNB2 2526/4885
US-20090191153-A1 OXIMYL MACROCYCLIC DERIVATIVES CYP3A4, CYP4A22, HCCS ALDH1A1 858/4885HTT 4539/4885CHRNB2 4867/4885
US-20090156800-A1 PROCESS FOR MAKING MACROCYCLIC OXIMYL HEPATITIS C PROTEASE INHIBITORS PREP, HCCS, PEPD ALDH1A1 2140/4885HTT 3278/4885CHRNB2 4867/4885
US-10669258-B2 3-sulfonyl-5-aminopyridine-2,4-diol APJ agonists AP3D1, KCNJ5, TBXA2R ALDH1A1 899/4885HTT 4234/4885CHRNB2 405/4885
US-10752610-B2 Pharmaceutical compounds CHRM1, CHRM2, CHRM4 ALDH1A1 1597/4885HTT 1912/4885CHRNB2 49/4885

“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.