SCHEMBL28860903

SCHEMBL28860903

Nc1ccc(-c2cc[nH]c2-c2ccc(N)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.50
GCGR P47871 2/20 0.50
CYP3A4 P08684 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
PTGS2 P35354 1/20 0.44
MAPT P10636 5/20 0.39
TAAR1 Q96RJ0 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ASIC3 Q9UHC3 1/20 0.38
APP P05067 1/20 0.36
KIT P10721 1/20 0.35
KDR P35968 1/20 0.35
FLT3 P36888 1/20 0.35
PIK3CD O00329 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CB P42338 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
SCHEMBL27682745 0.78 ALDH1A1 (0.48) MAPK14GCGRCYP3A4TDP1ALDH1A1
SCHEMBL10993716 0.76 MAPK14 (0.78) MAPK14GCGRPTGS2
SCHEMBL3424232 0.75 MAPT (0.52) MAPK14GCGRCYP3A4ALDH1A1PTGS2
SCHEMBL1925378 0.71 MAPT (0.41) CYP3A4TDP1ALDH1A1TP53PTGS2
SCHEMBL1925897 0.71 CCNC (0.39) CYP3A4TDP1ALDH1A1TP53MAPT
SCHEMBL28336784 0.71 MAPK14 (0.46) MAPK14GCGRTDP1ALDH1A1TP53
SCHEMBL10970446 0.71 IDO1 (0.55) MAPK14GCGRPTGS2MAPTMEN1
SCHEMBL8962658 0.70 RPS6KA3 (0.56) MAPK14GCGRMAPT
SCHEMBL2285019 0.70 MAPK14 (0.68) MAPK14GCGRPTGS2MAPT
SCHEMBL26106347 0.68 ALDH1A1 (0.62) CYP3A4TDP1ALDH1A1TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108129682-A The method that Kapton is prepared using diphenyl ether tetracid dianhydride 桂林理工大学 2018-06-08 CN disclosed