SCHEMBL5776214

SCHEMBL5776214

CNC(=O)c1cc2ncccc2s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN3B O60391 1/20 0.59
GRIN1 Q05586 1/20 0.59
GRIN2C Q14957 1/20 0.59
POLB P06746 1/20 0.55
PKM P14618 1/20 0.55
NAMPT P43490 1/20 0.53
PLK1 P53350 2/20 0.50
ALOX5 P09917 1/20 0.46
KDM4E B2RXH2 4/20 0.43
MAPT P10636 2/20 0.43
HPGD P15428 2/20 0.43
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.43
GAA P10253 2/20 0.43
TMIGD3 P0DMS9 1/20 0.43
ADORA1 P30542 1/20 0.43
STAT1 P42224 1/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43

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
SCHEMBL10650333 0.82 GRIN3B (0.52) GRIN3BGRIN1GRIN2CPOLBNAMPT
SCHEMBL843685 0.81 GRIN3B (0.52) GRIN3BGRIN1GRIN2CPOLBNAMPT
SCHEMBL29368089 0.81 GRIN3B (0.52) GRIN3BGRIN1GRIN2CPOLBNAMPT
SCHEMBL29365840 0.80 GRIN3B (0.57) GRIN3BGRIN1GRIN2CNAMPTALOX5
SCHEMBL843784 0.80 GRIN3B (0.57) GRIN3BGRIN1GRIN2CNAMPTALOX5
SCHEMBL31108975 0.79 GRIN3B (0.56) GRIN3BGRIN1GRIN2CNAMPTPLK1
SCHEMBL1217553 0.79 GRIN3B (0.56) GRIN3BGRIN1GRIN2CNAMPTPLK1
SCHEMBL3308576 0.79 GRIN3B (0.56) GRIN3BGRIN1GRIN2CNAMPTALOX5
SCHEMBL5775228 0.78 GRIN3B (0.49) GRIN3BGRIN1GRIN2CPOLBNAMPT
Lithium Ion SCHEMBL3308570 0.78 GRIN3B (0.51) GRIN3BGRIN1GRIN2CPOLBNAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1660503-A1 NAPHTHALENE CARBOXAMIDES AND THEIR DERIVATIVES USEFUL AS NEW ANTI-ANGIOGENIC AGENTS PFIZER INC. (US) 2006-05-31 EP disclosed
EP-1515975-A1 BENZOFUSED HETEROARYL AMIDE DERIVATIVES OF THIENOPYRIDINES USEFUL AS THERAPEUTIC AGENTS, PHARMACEUTICAL COMPOSITIONS INCLUDING THE SAME, AND METHODS FOR THEIR USE PFIZER INC. (US) 2005-03-23 EP disclosed
WO-2005021553-A1 NAPHTHALENE CARBOXAMIDES AND THEIR DERIVATIVES USEFUL AS NEW ANTI-ANGIOGENIC AGENTS PFIZER INC. (US) 2005-03-10 WO disclosed
WO-2003106462-A1 BENZOFUSED HETEROARYL AMIDE DERIVATIVES OF THIENOPYRIDINES USEFUL AS THERAPEUTIC AGENTS, PHARMACEUTICAL COMPOSITIONS INCLUDING THE SAME, AND METHODS FOR THEIR USE PFIZER INC. (US) 2003-12-24 WO disclosed