SCHEMBL14268574

SCHEMBL14268574

CN(C)c1ccc2c(c1)C1=CC(=[N+](C)C)C=CC1=C2c1ccccc1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 3/20 0.39
▸ MAPK1 P28482 3/20 0.39
▸ HIF1A Q16665 3/20 0.39
▸ TDP1 Q9NUW8 3/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ HTT P42858 2/20 0.39
▸ TP53 P04637 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ ALOX12 P18054 2/20 0.39
▸ RECQL P46063 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ ALOX15 P16050 1/20 0.39

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
SCHEMBL14607774 0.89 THRB (0.35) THRBMAPK1HIF1ATDP1MEN1
SCHEMBL14268589 0.85 MEN1 (0.37) THRBMAPK1HIF1ATDP1MEN1
SCHEMBL14268573 0.83 THRB (0.38) THRBMAPK1HIF1ATDP1MEN1
SCHEMBL16263283 0.81 THRB (0.34) THRBMAPK1HIF1ATDP1MEN1
SCHEMBL23774924 0.81 THRB (0.34) THRBMAPK1HIF1ATDP1MEN1
SCHEMBL14268570 0.80 THRB (0.33) THRBMAPK1HIF1ATDP1MEN1
SCHEMBL14268578 0.79 HTT (0.36) THRBMAPK1HIF1ATDP1MEN1
SCHEMBL14268588 0.78 TDP1 (0.38) MAPK1TDP1MEN1KMT2ASMN1; SMN2
SCHEMBL12387272 0.78 TDP1 (0.41) THRBMAPK1HIF1ATDP1MEN1
SCHEMBL23945091 0.78 THRB (0.32) THRBMAPK1HIF1ATDP1MEN1

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
US-7329289-B2 Use of triarylmethane derivatives as direct dyes in a dye composition, composition and implementation process L'Oréal, S.A. (FR) 2008-02-12 — — US disclosed
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