SCHEMBL8174643

SCHEMBL8174643

Cc1ccc(Sc2ccc(C)c(N)c2)cc1N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.54
TDP1 Q9NUW8 4/20 0.54
CASP1 P29466 2/20 0.54
CYP3A4 P08684 7/20 0.50
MAPT P10636 3/20 0.45
TSHR P16473 5/20 0.42
MAPK1 P28482 2/20 0.42
KDM4E B2RXH2 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
HPGD P15428 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
ALOX15 P16050 2/20 0.34
HSD17B10 Q99714 2/20 0.34
CYP1A2 P05177 1/20 0.34
CASP7 P55210 1/20 0.34
HIF1A Q16665 1/20 0.34

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
SCHEMBL21301917 0.91 ALDH1A1 (0.58) ALDH1A1TDP1CASP1CYP3A4MAPT
SCHEMBL8126370 0.85 ALDH1A1 (0.54) ALDH1A1TDP1CASP1CYP3A4MAPT
SCHEMBL26936582 0.84 ALDH1A1 (0.41) ALDH1A1TDP1CASP1CYP3A4MAPT
SCHEMBL17527000 0.80 CASP1 (0.55) ALDH1A1TDP1CASP1CYP3A4MAPT
SCHEMBL273206 0.80 CYP3A4 (0.54) ALDH1A1TDP1CASP1CYP3A4MAPT
SCHEMBL17527051 0.78 TDP1 (0.38) ALDH1A1TDP1CASP1CYP3A4MAPT
SCHEMBL17526965 0.76 CASP1 (0.50) ALDH1A1TDP1CASP1CYP3A4MAPT
SCHEMBL12775090 0.76 TDP1 (0.52) ALDH1A1TDP1CASP1CYP3A4MAPT
SCHEMBL30832958 0.76 ALDH1A1 (0.50) ALDH1A1TDP1CYP3A4MAPTTSHR
SCHEMBL47860 0.76 ALDH1A1 (0.50) ALDH1A1TDP1CYP3A4MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6051722-A PRECURSOR FOR POLYIMIDE COPOLYMER; USABLE IN OPTICAL LONG-DISTANCE COMMUNICATION, SIGNAL PROCESSING, PHOTOELECTRIC HYBRID CIRCUITS AND OPTICAL COMPUTERS HITACHI CHEMICAL COMPANY, LTD. (JP) 2000-04-18 US disclosed
EP-0621299-B1 Solutions of polyimide-forming substances and their use as coating material BASF LACKE & FARBEN (DE) 1997-07-09 EP disclosed
EP-0596150-B1 Solutions of polyimide precursors BASF LACKE & FARBEN (DE) 1997-02-05 EP disclosed
EP-0596149-B1 Solutions of polyimide precursors BASF LACKE & FARBEN (DE) 1996-10-16 EP disclosed
US-5489644-A COMPRISING AROMATIC DIAMINES AND TETRAESTER OF AROMATIC TETRACARBOXYLIC ACID; PROTECTIVE COATING FOR METALS, SILICON WAFERS, GLASS BASF LACKE + FARBEN (DE) 1996-02-06 US disclosed
EP-0621299-A1 Solutions of polyimide-forming substances and their use as coating material BASF Lacke + Farben AG (DE) 1994-10-26 EP disclosed
US-5332799-A Aromatic diamines, diesters of aromatic tetracarboxylic acids, circuit coatings BASF LACKE+FARBEN AKTIENGESELLSCHAFT (DE) 1994-07-26 US disclosed
EP-0596150-A1 Solutions of polyimide precursors BASF Lacke + Farben Aktiengesellschaft (DE) 1994-05-11 EP disclosed
EP-0596149-A1 Solutions of polyimide precursors BASF Lacke + Farben Aktiengesellschaft (DE) 1994-05-11 EP disclosed
US-5264545-A Aromatic or partly aromatic diamine with tetracarboxylic acid BASF LACKE+FARBEN AKTIENGESELLSCHAFT (DE) 1993-11-23 US disclosed