SCHEMBL9136304

SCHEMBL9136304

Nc1ccc(-c2ccccc2-c2cccc(O)c2)c(-c2cccc(O)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
PIK3CG P48736 1/20 0.49
CDK5 Q00535 1/20 0.47
CDK5R1 Q15078 1/20 0.47
PTPRC P08575 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 1/20 0.47
APAF1 O14727 1/20 0.47
TDP2 O95551 1/20 0.47
NSD2 O96028 1/20 0.47
LMNA P02545 1/20 0.47

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
SCHEMBL2957667 0.89 HSD17B1 (0.50) ALDH1A1TDP1CA12CA1CA2
SCHEMBL3680161 0.84 HSD17B1 (0.61) ALDH1A1CA12CA2CA9CA14
SCHEMBL5685565 0.83 CA12 (0.56) ALDH1A1TDP1CA12CA1CA2
SCHEMBL17051267 0.82 HSD17B1 (0.58) ALDH1A1CA12CA2CA9CA14
SCHEMBL4779452 0.82 HSD17B1 (0.64) ALDH1A1CA12CA2CA9CA14
SCHEMBL2989031 0.81 MAOA (0.57) ALDH1A1TDP1CDK5CDK5R1PTPRC
SCHEMBL6011365 0.81 CA12 (0.54) ALDH1A1TDP1CA12CA1CA2
SCHEMBL6573001 0.81 CA12 (0.54) ALDH1A1TDP1CA12CA1CA2
SCHEMBL1099351 0.81 MAOA (0.57) ALDH1A1TDP1CDK5CDK5R1PTPRC
SCHEMBL11601339 0.81 ALOX5 (0.59) ALDH1A1CDK5CDK5R1HPGDHSD17B1

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-5288836-A Low temperature interfacial polymerization; photreceptor materials XEROX CORPORATION (US) 1994-02-22 US claimed
US-5419992-A Photoconductive imaging member XEROX CORPORATION (US) 1995-05-30 US disclosed
US-5288836-A Low temperature interfacial polymerization; photreceptor materials XEROX CORPORATION (US) 1994-02-22 US disclosed