SCHEMBL585745

SCHEMBL585745

Oc1ccc(Nc2ccc(Nc3ccccc3)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.72
HSD17B10 Q99714 5/20 0.72
TSHR P16473 4/20 0.72
TDP1 Q9NUW8 4/20 0.72
ALOX12 P18054 3/20 0.72
L3MBTL1 Q9Y468 3/20 0.72
ALOX15 P16050 2/20 0.72
PTGS1 P23219 1/20 0.72
SLC6A2 P23975 1/20 0.72
MAPK1 P28482 1/20 0.72
PTGS2 P35354 1/20 0.72
HTR2B P41595 1/20 0.72
CYP3A4 P08684 5/20 0.62
GAA P10253 4/20 0.60
KMT2A Q03164 3/20 0.60
LMNA P02545 3/20 0.60
MAOA P21397 2/20 0.60
MAOB P27338 2/20 0.60
S100B P04271 1/20 0.60
MAPT P10636 6/20 0.56

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
SCHEMBL3371479 1.00 ALDH1A1 (0.72) ALDH1A1HSD17B10TSHRTDP1ALOX12
SCHEMBL3369514 1.00 ALDH1A1 (0.72) ALDH1A1HSD17B10TSHRTDP1ALOX12
SCHEMBL92754 1.00 ALDH1A1 (0.72) ALDH1A1HSD17B10TSHRTDP1ALOX12
SCHEMBL27456694 0.97 ALDH1A1 (0.68) ALDH1A1HSD17B10TSHRTDP1ALOX12
Diphenylamine SCHEMBL5867343 0.92 CYP3A4 (0.73) ALDH1A1HSD17B10TSHRTDP1ALOX12
Diphenylamine SCHEMBL28117645 0.89 CYP3A4 (0.70) ALDH1A1HSD17B10TSHRTDP1ALOX12
Acetic Acid SCHEMBL9525170 0.89 MAPT (0.64) ALDH1A1HSD17B10TSHRTDP1ALOX12
SCHEMBL1921921 0.88 ALDH1A1 (0.57) ALDH1A1HSD17B10TSHRTDP1ALOX12
SCHEMBL306231 0.88 ALDH1A1 (0.57) ALDH1A1HSD17B10TSHRTDP1ALOX12
SCHEMBL10656197 0.87 MMP3 (0.71) ALDH1A1HSD17B10TSHRTDP1ALOX12

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4696756-A SILOXANE BLEND TORAY SILICONE CO., LTD. (JP) 1987-09-29 US claimed
US-4683319-A POLYSILOXANE REACTED WITH AROMATIC AMINOPHENOL, VISCOSITY STABILIZER TORAY SILICONE CO., LTD. (JP) 1987-07-28 US claimed
JP-62142681-A None JP disclosed
EP-2900746-B1 RUBBER COMPOSITION AND METHOD FOR LOW RESIN CROSSLINKING MICHELIN & CIE (FR) 2019-09-11 EP disclosed
US-9708459-B2 Rubber composition and method for low resin crosslinking COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2017-07-18 US disclosed
EP-2062870-B1 OLIGOANILINE COMPOUNDS NISSAN CHEMICAL IND LTD (JP) 2016-11-09 EP disclosed
US-20150252167-A1 RUBBER COMPOSITION AND METHOD FOR LOW RESIN CROSSLINKING COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2015-09-10 US disclosed
EP-2900746-A1 RUBBER COMPOSITION AND METHOD FOR LOW RESIN CROSSLINKING Compagnie Générale des Etablissements Michelin (FR) 2015-08-05 EP disclosed
US-8906519-B2 Oligoaniline compounds NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-12-09 US disclosed
US-20140128502-A1 DIBLOCK COOPOLYMER MODIFIED NANOPARTICLE/POLYMER COMPOSITES RENSSELAER POLYTECHNIC INSTITUTE (US) 2014-05-08 US disclosed
EP-2417172-A1 DIBLOCK COPOLYMER MODIFIED NANOPARTICLE/POLYMER COMPOSITES RENSSELAER POLYTECHNIC INSTITUTE (US) 2012-02-15 EP disclosed
EP-0479578-A1 Color-forming recording material MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-04-08 EP disclosed
US-4990552-A Mixture with soluble platinum and alkynyloxy compound SHIN-ETSU CHEMICAL CO., LTD. (JP) 1991-02-05 US disclosed
EP-0331074-A2 Co-polymer-bound amine antioxidants HERCULES INCORPORATED (US) 1989-09-06 EP disclosed
US-4812543-A RING OPENING POLYMERIZATION HERCULES INCORPORATED (US) 1989-03-14 US disclosed
US-4772409-A BLEND OF METHYLPHENYL POLYSILOXANE AND AN AMINE-MODIFIED POLYSILOXANE SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-09-20 US disclosed
JP-S62142681-A COLOR FORMING RECORDING MATERIAL SHIN NISSO KAKO CO LTD 1987-06-26 JP disclosed
US-4537691-A BLENDS OF POLYDIMETHYLSILOXANE WITH A COMBINATION OF HYDROXY ANDANIMINO-SUBSTITUTED PHENOIXY POLYSILOXANE SHIN-ETSU CHEMICAL CO. LTD. (JP) 1985-08-27 US disclosed
US-4124565-A STABILIZERS, ANTIOXIDANTS, ANTIOZONANTS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1978-11-07 US disclosed
US-4113595-A POLYOLEFIN, ACETYLENIC COMPOUND, SECONDARY AMINE JAPAN ATOMIC ENERGY RESEARCH INSTITUTE (JP) 1978-09-12 US disclosed