SCHEMBL9150855

SCHEMBL9150855

O=C(Nc1cccc(O)c1C(=O)O)Oc1ccc(-c2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.62
▸ KMT2A Q03164 1/20 0.62
▸ TRPV1 Q8NER1 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ MAPT P10636 1/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ PORCN Q9H237 1/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA7 P43166 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ CA14 Q9ULX7 1/20 0.43
▸ GAA P10253 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42

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
SCHEMBL8655082 0.91 TRPV1 (0.55) MEN1KMT2ATRPV1ALDH1A1KDM4E
SCHEMBL8654717 0.86 MEN1 (0.51) MEN1KMT2ATRPV1ALDH1A1KDM4E
SCHEMBL8653617 0.86 KMT2A (0.45) MEN1KMT2ATRPV1ALDH1A1KDM4E
SCHEMBL8654626 0.86 GAA (0.56) MEN1KMT2ATRPV1ALDH1A1KDM4E
SCHEMBL9151062 0.83 ALDH1A1 (0.53) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL9150336 0.83 KMT2A (0.42) MEN1KMT2ATRPV1ALDH1A1KDM4E
SCHEMBL9146178 0.83 MGLL (0.43) MEN1KMT2ATRPV1ALDH1A1KDM4E
SCHEMBL9147350 0.83 MAPT (0.56) MEN1KMT2ATRPV1ALDH1A1KDM4E
SCHEMBL9151339 0.81 STS (0.47) MEN1KMT2ATRPV1ALDH1A1KDM4E
SCHEMBL9150808 0.81 NPC1 (0.55) KMT2ATRPV1ALDH1A1KDM4EMAPT

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-5476957-A Dye for heat sensitive recording MITSUI TOATSU CHEMICALS, INC. (JP) 1995-12-19 — — US disclosed
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