SCHEMBL7748035

SCHEMBL7748035

Nc1ccc2cc(N)c(N)cc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 5/20 0.67
ALDH1A1 P00352 4/20 0.67
CYP3A4 P08684 4/20 0.67
HSD17B10 Q99714 3/20 0.67
CASP7 P55210 2/20 0.67
HBB P68871 2/20 0.67
HIF1A Q16665 2/20 0.67
ALOX15 P16050 1/20 0.67
TDP1 Q9NUW8 1/20 0.67
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
KDM4E B2RXH2 5/20 0.56
MAPT P10636 5/20 0.56
PLAU P00749 2/20 0.46
HTT P42858 4/20 0.46
LMNA P02545 3/20 0.46
F2 P00734 1/20 0.46
CHRM2 P08172 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46

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
SCHEMBL28717736 0.90 ALDH1A1 (0.86) CASP1ALDH1A1CYP3A4HSD17B10CASP7
SCHEMBL30413338 0.88 ALDH1A1 (0.83) CASP1ALDH1A1CYP3A4HSD17B10CASP7
SCHEMBL3412594 0.88 ALDH1A1 (0.78) CASP1ALDH1A1CYP3A4HSD17B10CASP7
SCHEMBL442351 0.88 ALDH1A1 (0.83) CASP1ALDH1A1CYP3A4HSD17B10CASP7
SCHEMBL2893484 0.88 ALDH1A1 (0.83) CASP1ALDH1A1CYP3A4HSD17B10CASP7
SCHEMBL29165604 0.88 ALDH1A1 (0.83) CASP1ALDH1A1CYP3A4HSD17B10CASP7
SCHEMBL145891 0.87 ALDH1A1 (0.77) CASP1ALDH1A1CYP3A4HSD17B10CASP7
SCHEMBL29367325 0.87 ALDH1A1 (0.77) CASP1ALDH1A1CYP3A4HSD17B10CASP7
SCHEMBL202182 0.84 ALDH1A1 (0.72) CASP1ALDH1A1CYP3A4HSD17B10CASP7
SCHEMBL29468144 0.84 ALDH1A1 (0.72) CASP1ALDH1A1CYP3A4HSD17B10CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4198163-A1 METAL PATTERNING MATERIAL, AMINE COMPOUND, ELECTRONIC DEVICE, AND METHOD FOR FORMING METAL PATTERN Tosoh Corporation (JP) 2023-06-21 EP disclosed
WO-2021085284-A1 OPTICAL FILM AND FLEXIBLE DISPLAY DEVICE 住友化学株式会社 2021-05-06 WO disclosed
WO-2021085283-A1 POLYAMIDEIMIDE RESIN 住友化学株式会社 2021-05-06 WO disclosed
US-9526739-B2 Compositions and methods to treat cardiac diseases UNIVERSITY OF CONNECTICUT (US) 2016-12-27 US disclosed
EP-0710684-B1 Preparation process of polyhydroxycarboxylic acid MITSUI CHEMICALS INC (JP) 2001-01-31 EP disclosed
US-5770683-A Preparation process of polyhydroxycarboxylic acid MITSUI TOATSU CHEMICALS, INC. (JP) 1998-06-23 US disclosed
EP-0710684-A2 Preparation process of polyhydroxycarboxylic acid MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-05-08 EP disclosed
EP-0705863-A1 Two stage melt polymerization process for making polybenzimidazoles HOECHST CELANESE CORPORATION (US) 1996-04-10 EP disclosed
US-4717764-A Two stage melt polymerization process for making polymers containing aromatic amide groups CELANESE CORPORATION (US) 1988-01-05 US disclosed