SCHEMBL7419173

SCHEMBL7419173

O=C(Cl)N1CCC(Cc2ccccc2)CC1

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.65
CYP2C19 P33261 3/20 0.65
MAPK14 Q16539 3/20 0.65
HTR2B P41595 2/20 0.65
FAAH O00519 2/20 0.64
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
MGLL Q99685 1/20 0.62
POLB P06746 2/20 0.62
TACR3 P29371 1/20 0.61
LMNA P02545 1/20 0.61
GAA P10253 1/20 0.61

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
SCHEMBL1761001 0.90 TACR3 (0.71) CYP2C9CYP2C19MAPK14HTR2BFAAH
SCHEMBL4576675 0.87 L3MBTL1 (0.64) CYP2C9CYP2C19MAPK14HTR2BFAAH
SCHEMBL2636547 0.86 MEN1 (0.68) CYP2C9CYP2C19MAPK14HTR2BFAAH
SCHEMBL4576736 0.85 L3MBTL1 (0.69) CYP2C9CYP2C19MAPK14HTR2BFAAH
SCHEMBL3026559 0.85 CYP2C9 (0.67) CYP2C9CYP2C19MAPK14HTR2BFAAH
SCHEMBL1761030 0.84 MEN1 (0.55) CYP2C9CYP2C19MAPK14MEN1KMT2A
SCHEMBL2243090 0.84 ALDH1A1 (0.64) CYP2C9CYP2C19MAPK14HTR2BFAAH
SCHEMBL12466880 0.83 MEN1 (0.64) CYP2C9CYP2C19MAPK14HTR2BFAAH
SCHEMBL14252818 0.83 MEN1 (0.64) CYP2C9CYP2C19MAPK14HTR2BFAAH
SCHEMBL8815358 0.83 MEN1 (0.64) CYP2C9CYP2C19MAPK14HTR2BFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114401969-A Heterocyclic compounds 豪夫迈·罗氏有限公司 2022-04-26 CN disclosed
US-6335324-B1 TREATING ASTHMA OR ALLERGIC RHINITIS BRISTOL-MYERS SQUIBB CO. 2002-01-01 US disclosed
EP-1089973-A4 AMIDINO AND GUANIDINO AZETIDINONE TRYPTASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2001-12-12 EP disclosed
EP-1089973-A1 AMIDINO AND GUANIDINO AZETIDINONE TRYPTASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2001-04-11 EP disclosed
WO-1999067215-A1 AMIDINO AND GUANIDINO AZETIDINONE TRYPTASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-12-29 WO disclosed
US-4136180-A HYPOLIPIDEMIC SUBSTITUTED STYRENESULFONYLUREAS PFIZER INC. (US) 1979-01-23 US disclosed
US-4062960-A Hypolipidemic alkenesulfonamides PFIZER INC. (US) 1977-12-13 US disclosed
US-3983107-A ARTERIOSCLEROSIS PFIZER INC. (US) 1976-09-28 US disclosed