SCHEMBL2489015

SCHEMBL2489015

Cc1ccc2nc(-c3cc(N)ccc3Cl)oc2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPS6KA3 P51812 1/20 0.61
MAPT P10636 12/20 0.61
SMN1; SMN2 Q16637 10/20 0.61
RAB9A P51151 10/20 0.61
NPC1 O15118 9/20 0.61
ALDH1A1 P00352 8/20 0.61
KDM4E B2RXH2 7/20 0.61
HPGD P15428 6/20 0.61
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
TDP1 Q9NUW8 1/20 0.61
TP53 P04637 5/20 0.61
HSD17B10 Q99714 4/20 0.61
ALOX15 P16050 1/20 0.61
AGPAT2 O15120 2/20 0.60
XBP1 P17861 1/20 0.58
HIF1A Q16665 1/20 0.58
GAA P10253 2/20 0.57
CASP3 P42574 1/20 0.57
SENP8 Q96LD8 1/20 0.57

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
SCHEMBL2491850 0.90 MAPT (0.70) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL30831359 0.85 RPS6KA3 (0.64) RPS6KA3MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL4514393 0.85 MAPT (0.60) RPS6KA3MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL2242337 0.84 MAPT (0.66) RPS6KA3MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL2493940 0.82 MAPT (0.69) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL16972929 0.82 HSD17B10 (0.60) RPS6KA3MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL11744415 0.79 MAPT (0.61) RPS6KA3MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL2247430 0.79 NPC1 (0.77) RPS6KA3MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL2242336 0.79 MAPT (0.75) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL11749880 0.78 MAPT (0.56) RPS6KA3MAPTSMN1; SMN2RAB9ANPC1

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