SCHEMBL9488788

SCHEMBL9488788

COC1=CC(=Nc2ccc(N(C)C)cc2)C=CC1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PABPC1 P11940 1/20 0.47
▸ ERBB2 P04626 1/20 0.44
▸ MAPK1 P28482 5/20 0.41
▸ ALDH1A1 P00352 5/20 0.41
▸ TSHR P16473 3/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ TP53 P04637 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ MAPT P10636 6/20 0.38
▸ NPC1 O15118 5/20 0.38
▸ MEN1 O00255 5/20 0.38
▸ KMT2A Q03164 5/20 0.38
▸ RAB9A P51151 4/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ THRB P10828 2/20 0.38
▸ ESR1 P03372 1/20 0.38
▸ TNNI3 P19429 1/20 0.38
▸ TNNT2 P45379 1/20 0.38
▸ TNNC1 P63316 1/20 0.38
▸ PLEC Q15149 1/20 0.38

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
SCHEMBL2680700 0.81 PABPC1 (0.56) PABPC1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL9490925 0.81 ERBB2 (0.50) PABPC1ERBB2MAPK1ALDH1A1HSD17B10
SCHEMBL11308089 0.80 PABPC1 (0.48) PABPC1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL126305 0.75 PABPC1 (0.60) PABPC1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL11316014 0.73 PABPC1 (0.42) PABPC1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL11425344 0.72 PABPC1 (0.41) PABPC1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL14612968 0.68 ALDH1A1 (0.45) PABPC1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL12267743 0.68 ALDH1A1 (0.45) PABPC1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL9491886 0.68 PABPC1 (0.47) PABPC1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL11690642 0.68 PABPC1 (0.51) PABPC1MAPK1ALDH1A1TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5258281-A Light sensitive silver halide multilayer elements with dyes and heat development accelerators CANON KABUSHIKI KAISHA (JP) 1993-11-02 — — US disclosed
EP-0486246-A1 Heat-developable photosensitive material CANON KABUSHIKI KAISHA (JP) 1992-05-20 — — EP disclosed
US-4248591-A HAIR DYES L'OREAL (FR) 1981-02-03 — — US disclosed
US-4221729-A HAIR DYES L'OREAL (FR) 1980-09-09 — — US disclosed
US-3977825-A Indoanilines in keratinic fiber dye cmpositions L'OREAL (FR) 1976-08-31 — — US disclosed
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