SCHEMBL7370671

SCHEMBL7370671

Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N(C)c3ccc(Cl)cc3OCCCCCC(=O)O)c(Cl)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GCGR P47871 3/20 0.41
FABP4 P15090 3/20 0.41
AVPR2 P30518 2/20 0.41
AVPR1A P37288 1/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PNLIP P16233 3/20 0.40
PYGL P06737 1/20 0.40
MTTP P55157 2/20 0.39
TP53 P04637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL7374840 0.93 PYGL (0.41) GCGRFABP4AVPR2AVPR1AMEN1
SCHEMBL7372395 0.93 MTTP (0.43) GCGRFABP4AVPR2POLBMTTP
SCHEMBL8812526 0.93 GCGR (0.40) GCGRFABP4MEN1POLBMAPT
SCHEMBL7374161 0.92 AVPR2 (0.40) GCGRAVPR2AVPR1AMEN1POLB
SCHEMBL7371570 0.92 MEN1 (0.46) GCGRFABP4AVPR2AVPR1AMEN1
SCHEMBL7379386 0.88 CYP1A2 (0.44) AVPR2AVPR1AMEN1CYP2C19KMT2A
SCHEMBL7512593 0.88 CYP19A1 (0.45) AVPR2AVPR1AMEN1MAPTKMT2A
SCHEMBL7375471 0.87 FABP4 (0.41) FABP4MEN1POLBMAPTCYP2C19
SCHEMBL7378099 0.86 L3MBTL1 (0.43) FABP4MEN1POLBMAPTCYP2C19
SCHEMBL7375342 0.85 PNLIP (0.39) AVPR2AVPR1AMEN1MAPTCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6211242-B1 CARDIOVASCULAR DISORDERS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-04-03 US disclosed
EP-0757670-B1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 1999-01-13 EP disclosed
WO-1995029152-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-02 WO disclosed