SCHEMBL8963703

SCHEMBL8963703

Cc1[nH]c(-c2ccc(Cl)cc2)nc1C=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.51
GAA P10253 3/20 0.45
MGAM O43451 1/20 0.45
SI P14410 1/20 0.45
MGAM2 Q2M2H8 1/20 0.45
TNKS2 Q9H2K2 5/20 0.44
TNKS O95271 4/20 0.44
PARP2 Q9UGN5 3/20 0.44
NPY5R Q15761 1/20 0.44
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
HPGD P15428 2/20 0.42
GUSB P08236 2/20 0.42
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
APP P05067 1/20 0.42

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
SCHEMBL11349253 0.86 TNKS2 (0.44) MAPK1GAATNKS2TNKSKDM4E
SCHEMBL8963654 0.83 PIN1 (0.56) MAPK1GAATNKS2TNKSNPY5R
SCHEMBL8963917 0.81 PIN1 (0.60) GAAMGAMSIMGAM2NPY5R
SCHEMBL8963927 0.81 KDM4E (0.48) TNKS2TNKSKDM4EALDH1A1NPC1
SCHEMBL8963419 0.81 NPC1 (0.48) MAPK1GAATNKS2TNKSKDM4E
SCHEMBL6655087 0.80 TNKS2 (0.48) TNKS2TNKSPARP2KDM4ENPC1
SCHEMBL11319685 0.78 MMP2 (0.52) MAPK1GAATNKS2TNKSPARP2
SCHEMBL23758268 0.77 MAPK1 (0.54) MAPK1GAAMGAMSIMGAM2
SCHEMBL8963588 0.74 GAA (0.49) GAAMGAMSIMGAM2KDM4E
SCHEMBL8963874 0.74 PIN1 (0.58) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5514800-A CALCIUM CHANNEL BLOCKERS, CEREBRAL ISCHEMIA SYNTEX PHARMACEUTICALS, LTD. (GB) 1996-05-07 US disclosed
US-5276034-A Cardiovascular disorders, nervous system disorders, diuretics, antiischemic agents or antispasmodic agents SYNTEX PHARMACEUTICAL LTD. (GB) 1994-01-04 US disclosed
US-5252736-A Calcium channel antagonists SYNTEX PHARMACEUTICALS, LTD. (GB) 1993-10-12 US disclosed
EP-0289227-B1 SUBSTITUTED IMIDAZOLYL-ALKYL-PIPERAZINE AND -DIAZEPINE DERIVATIVES SYNTEX PHARMACEUTICALS LTD. (GB) 1992-04-08 EP disclosed
US-5091428-A Calcium channel blockers preferential for cerebral blood vessels SYNTEX PHARMACEUTICALS, LTD. (BM) 1992-02-25 US disclosed
US-5043447-A Substituted imidazolyl-alkyl-piperazine and -diazepine derivatives SYNTEX PHARMACEUTICALS, LTD. (GB) 1991-08-27 US disclosed
US-5010075-A Antiepilepic, hypotensive, antiarrhythmia, antiischemic agent SYNTEX PHARMACEUTICALS LTD. (GB) 1991-04-23 US disclosed
US-4935417-A CALCIUM CHANNEL BLOCKERS SYNTEX PHARMACEUTICALS LTD. (BM) 1990-06-19 US disclosed
US-4829065-A Substituted imidazolyl-alkyl-piperazine and -diazepine derivatives SYNTEX PHARMACEUTICALS, LTD. (GB) 1989-05-09 US disclosed
EP-0289227-A1 Substituted imidazolyl-alkyl-piperazine and -diazepine derivatives SYNTEX PHARMACEUTICALS LTD. (GB) 1988-11-02 EP disclosed