SCHEMBL2492941

SCHEMBL2492941

Nc1ccc2oc(-c3ccc(Cl)cc3Cl)nc2c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 14/20 0.72
RAB9A P51151 11/20 0.72
SMN1; SMN2 Q16637 10/20 0.72
NPC1 O15118 10/20 0.72
TP53 P04637 7/20 0.72
XBP1 P17861 1/20 0.63
HIF1A Q16665 1/20 0.63
ESR1 P03372 1/20 0.58
ESR2 Q92731 1/20 0.58
KDM4E B2RXH2 9/20 0.58
ALDH1A1 P00352 9/20 0.58
HPGD P15428 4/20 0.58
GFER P55789 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
HSD17B10 Q99714 5/20 0.56
TSHR P16473 1/20 0.56
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
ALOX15 P16050 4/20 0.55
GAA P10253 4/20 0.55

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
SCHEMBL1734740 0.94 MAPT (0.68) MAPTRAB9ASMN1; SMN2NPC1TP53
SCHEMBL31360536 0.92 MAPT (0.78) MAPTRAB9ASMN1; SMN2NPC1TP53
SCHEMBL11443270 0.92 MAPT (0.78) MAPTRAB9ASMN1; SMN2NPC1TP53
SCHEMBL30967039 0.92 MAPT (0.78) MAPTRAB9ASMN1; SMN2NPC1TP53
SCHEMBL2488984 0.88 MAPT (0.75) MAPTRAB9ASMN1; SMN2NPC1TP53
SCHEMBL2242336 0.86 MAPT (0.75) MAPTRAB9ASMN1; SMN2NPC1TP53
SCHEMBL2489033 0.85 MAPT (0.71) MAPTRAB9ASMN1; SMN2NPC1TP53
SCHEMBL1735158 0.84 MAPT (0.58) MAPTRAB9ASMN1; SMN2NPC1TP53
SCHEMBL2242897 0.84 MAPT (1.00) MAPTRAB9ASMN1; SMN2NPC1TP53
SCHEMBL1733986 0.83 MAPT (0.57) MAPTRAB9ASMN1; SMN2NPC1TP53

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
US-8330039-B2 Solar cell modules with poly(vinyl butyral) encapsulant comprising unsaturated heterocyclic compound E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-11 US disclosed
EP-2380208-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. du Pont de Nemours and Company (US) 2011-10-26 EP disclosed
WO-2010085664-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-29 WO disclosed
US-20100180947-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-22 US disclosed