SCHEMBL9124995

SCHEMBL9124995

Cc1ccc(OC(=O)Nc2cc(Oc3ccc(-c4ccc(O)cc4)c(NC(=O)Oc4ccc(C)cc4)c3)ccc2-c2ccc(O)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ GAA P10253 2/20 0.42
▸ THRB P10828 2/20 0.42
▸ GLA P06280 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ CASP6 P55212 1/20 0.42
▸ GFER P55789 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ TRPV1 Q8NER1 1/20 0.39
▸ CYP1A2 P05177 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ ALDH1A1 P00352 2/20 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
SCHEMBL9126089 0.88 TRPV1 (0.51) MAPTKDM4EGAATHRBGLA
SCHEMBL9125818 0.87 TRPV1 (0.50) MAPTKDM4EGAATHRBGLA
SCHEMBL9128338 0.79 KDM4E (0.43) MAPTKDM4EGAATHRBGLA
SCHEMBL9126505 0.79 MEN1 (0.46) MEN1KMT2ATRPV1NPC1RAB9A
SCHEMBL9125161 0.78 KMT2A (0.44) MAPTKDM4EGAAGLAMEN1
SCHEMBL9124295 0.78 SMN1; SMN2 (0.49) MAPTKDM4ECYP1A2NPC1CYP2C9
SCHEMBL9126066 0.77 CRHBP (0.48) MAPTKDM4EGAAMEN1KMT2A
SCHEMBL9124991 0.76 KDM4E (0.44) MAPTKDM4EGAATHRBGLA
SCHEMBL9124336 0.76 SMN1; SMN2 (0.45) MAPTGAAMEN1KMT2ASMN1; SMN2
SCHEMBL9129140 0.75 GAA (0.49) MAPTKDM4EGAATHRBGLA

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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