SCHEMBL2644657

SCHEMBL2644657

C1=CCC(Nc2ccccc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
ALDH1A1 P00352 5/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.38
ALOX15 P16050 2/20 0.38
LMNA P02545 1/20 0.38
PKM P14618 1/20 0.38
ALOX12 P18054 1/20 0.38
RAD52 P43351 1/20 0.38
GFER P55789 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TDP1 Q9NUW8 3/20 0.37
POLB P06746 2/20 0.36
KDM4E B2RXH2 3/20 0.35
GAA P10253 2/20 0.35
HTT P42858 2/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35

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
SCHEMBL7165368 0.82 NR3C2 (0.42) CARM1PRMT6ALDH1A1MEN1KMT2A
SCHEMBL3796858 0.77 CARM1 (0.46) CARM1PRMT6ALDH1A1MEN1KMT2A
SCHEMBL11154452 0.77 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AMAPTALOX15
SCHEMBL11151263 0.77 EPHX1 (0.40) ALDH1A1KDM4EHTTSMN1; SMN2CCR6
SCHEMBL3696096 0.75 CARM1 (0.52) CARM1PRMT6ALDH1A1MEN1KMT2A
SCHEMBL236978 0.75 CARM1 (0.52) CARM1PRMT6ALDH1A1MEN1KMT2A
SCHEMBL4611546 0.74 PTGS2 (0.31) ALDH1A1MEN1KMT2AMAPTALOX15
Hydrochloric Acid SCHEMBL1170216 0.73 CARM1 (0.50) CARM1PRMT6ALDH1A1MEN1KMT2A
SCHEMBL24616539 0.72 ROCK2 (0.42) ALDH1A1MEN1KMT2AMAPTALOX15
SCHEMBL1425186 0.72 KDM4E (0.52) CARM1PRMT6ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020218680-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DIODE USING SAME 두산솔루스 주식회사 2020-10-29 WO disclosed
WO-2009124627-A1 FLUORINE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2009-10-15 WO disclosed
EP-1626717-A4 BENZIMIDAZOLES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE MERCK & CO INC (US) 2009-09-09 EP disclosed
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists NOVO NORDISK A/S (DK) 2009-06-04 US disclosed
EP-1626717-A2 BENZIMIDAZOLES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE Merck & Co., Inc. (US) 2006-02-22 EP disclosed
US-20050256175-A1 Novel glucagon antagonists/inverse agonists LAU JESPER 2005-11-17 US disclosed
EP-1183229-B1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK AS (DK) 2005-10-26 EP disclosed
US-20050203108-A1 Glucagon antagonists/inverse agonists PFIZER INC 2005-09-15 US disclosed
US-6881746-B2 Glucagon antagonists/inverse agonists NOVO NORDICK A/S (DK) 2005-04-19 US disclosed
EP-1519723-A1 NOVEL GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2005-04-06 EP disclosed
US-6503949-B1 Treating Type 2 diabetes, hyperglycemia, impaired glucose tolerance or obesity NORO NORDISK A/S (DK) 2003-01-07 US disclosed
US-20020187982-A1 Glucagon antagonists/inverse agonists NOVO NORDISK A/S (DK) 2002-12-12 US disclosed
WO-2002040444-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-05-23 WO disclosed
WO-2002040446-A1 GLUCAGON ANTAGONIST/INVERSE AGONIST NOVO NORDISK A/S (DK) 2002-05-23 WO disclosed
WO-2002040445-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-05-23 WO disclosed
EP-1183229-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2002-03-06 EP disclosed
WO-2000069810-A1 GLUCAGON ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2000-11-23 WO disclosed
US-5395971-A Molybdenum-catalyzed amination of olefins THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 1995-03-07 US disclosed
US-5349109-A Molybdenum-catalyzed amination of olefins THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 1994-09-20 US disclosed
US-4101575-A FUNGICIDES, BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 1978-07-18 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 (4 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-20050256175-A1 Novel glucagon antagonists/inverse agonists GLP1R, GCGR, GIPR CARM1 4825/4885PRMT6 3954/4885ALDH1A1 4836/4885
US-20050203108-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR CARM1 4344/4885PRMT6 3696/4885ALDH1A1 3968/4885
US-20090143592-A1 Glucagon Antagonists/Inverse Agonists GLP1R, GPR119, GCGR CARM1 4344/4885PRMT6 3696/4885ALDH1A1 3968/4885
US-20020187982-A1 Glucagon antagonists/inverse agonists GLP1R, GPR119, GCGR CARM1 4299/4885PRMT6 3619/4885ALDH1A1 3770/4885

“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.