SCHEMBL9124655

SCHEMBL9124655

O=C(Nc1ccccc1)Oc1cccc2ccc(O)cc12

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 12/20 0.60
▸ HSP90AA1 P07900 1/20 0.54
▸ GAA P10253 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ PGR P06401 1/20 0.49
▸ PTGS1 P23219 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ KMT2A Q03164 4/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ BLM P54132 1/20 0.48
▸ MEN1 O00255 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MAPT P10636 1/20 0.45
▸ RAB9A P51151 1/20 0.45

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
SCHEMBL9230576 0.85 ALDH1A1 (0.66) HSP90AA1GAAALDH1A1PGRPTGS1
SCHEMBL9126275 0.81 ALDH1A1 (0.69) TRPV1GAAALDH1A1PGRPTGS1
SCHEMBL9125053 0.77 ALDH1A1 (0.56) HSP90AA1GAAALDH1A1PGRPTGS1
SCHEMBL27965594 0.76 CYP3A4 (0.50) TRPV1GAAALDH1A1PGRPTGS1
SCHEMBL28731984 0.76 HSP90AA1 (0.56) HSP90AA1GAAALDH1A1PGRPTGS1
SCHEMBL26697277 0.75 FAAH (0.56) HSP90AA1GAAALDH1A1PTGS1KMT2A
SCHEMBL26697229 0.75 KMT2A (0.54) HSP90AA1GAAALDH1A1PTGS1KMT2A
SCHEMBL3582762 0.75 TRPV1 (1.00) TRPV1KMT2AKDM4EMEN1MAPT
SCHEMBL7095605 0.75 HSP90AA1 (0.54) HSP90AA1GAAALDH1A1PTGS1KMT2A
SCHEMBL9128171 0.74 ALDH1A1 (0.49) TRPV1HSP90AA1GAAALDH1A1PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0524419-B1 Heat-sensitive recording materials and phenol compounds MITSUI TOATSU CHEMICALS (JP) 1995-09-06 — — EP disclosed
US-5391806-A A storage stable chromogens as color-developing agent or stabilizers MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1995-02-21 — — US disclosed
US-5270281-A Chromogenic compound MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1993-12-14 — — US disclosed
EP-0524419-A1 Heat-sensitive recording materials and phenol compounds MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-01-27 — — EP disclosed
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