SCHEMBL7842738

SCHEMBL7842738

COCC1(Cc2ccccc2C)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
TSHR P16473 2/20 0.41
ALOX15 P16050 1/20 0.41
ATM Q13315 1/20 0.41
GPR119 Q8TDV5 1/20 0.41
TACR1 P25103 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
MCHR1 Q99705 1/20 0.41
PKM P14618 1/20 0.40

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
SCHEMBL7840954 0.89 POLB (0.53) POLBKDM4EALDH1A1TSHRALOX15
SCHEMBL8762096 0.83 OPRD1 (0.44) POLBKDM4EALDH1A1TSHRALOX15
SCHEMBL7842880 0.83 PKM (0.52) POLBKDM4EALDH1A1TSHRALOX15
SCHEMBL8762050 0.82 GPR119 (0.44) POLBKDM4ETSHRALOX15ATM
SCHEMBL25276674 0.80 GPR119 (0.48) POLBKDM4EALDH1A1TSHRGPR119
SCHEMBL9015653 0.80 TSHR (0.42) POLBKDM4ETSHRALOX15ATM
SCHEMBL7832576 0.80 GPR119 (0.48) POLBALDH1A1GPR119TACR1OPRD1
SCHEMBL7838737 0.79 GRM5 (0.48) TSHRALOX15ATMGPR119OPRD1
SCHEMBL9015671 0.78 POLB (0.42) POLBKDM4EALDH1A1TSHRALOX15
SCHEMBL9015640 0.78 GPR119 (0.43) KDM4ETSHRALOX15ATMGPR119

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944388-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-08-16 EP disclosed
US-6248756-B1 Inhibitors of farnesyl-protein transferase MERCK & CO., INC. 2001-06-19 US disclosed
EP-0944388-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-09-29 EP disclosed
US-5891889-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-04-06 US disclosed
EP-0777475-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 1997-12-03 EP disclosed
WO-1997038665-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-23 WO disclosed
EP-0777475-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO. INC. (US) 1997-06-11 EP disclosed
US-5576313-A ENZYME INHIBITORS AND ANTICARCINOGENIC AGENTS MERCK & CO., INC. (US) 1996-11-19 US disclosed
WO-1996006609-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1996-03-07 WO disclosed