SCHEMBL9126246

SCHEMBL9126246

O=C(Nc1ccccc1)Oc1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.66
▸ GAA P10253 4/20 0.66
▸ HTT P42858 1/20 0.66
▸ SMN1; SMN2 Q16637 1/20 0.66
▸ MAPT P10636 4/20 0.64
▸ KDM4E B2RXH2 3/20 0.64
▸ THRB P10828 2/20 0.64
▸ GFER P55789 2/20 0.64
▸ TDP1 Q9NUW8 2/20 0.64
▸ GLA P06280 1/20 0.64
▸ BLM P54132 1/20 0.64
▸ CASP6 P55212 1/20 0.64
▸ KMT2A Q03164 5/20 0.61
▸ USP2 O75604 1/20 0.61
▸ RAB9A P51151 1/20 0.60
▸ PORCN Q9H237 1/20 0.56
▸ RAD51 Q06609 1/20 0.55
▸ MEN1 O00255 3/20 0.55
▸ LMNA P02545 1/20 0.55
▸ TP53 P04637 1/20 0.55

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
SCHEMBL9125362 0.95 MAPT (0.67) ALDH1A1GAAHTTSMN1; SMN2MAPT
SCHEMBL9127280 0.93 ALDH1A1 (0.69) ALDH1A1GAAHTTSMN1; SMN2MAPT
SCHEMBL9124646 0.93 ALDH1A1 (0.69) ALDH1A1GAAHTTSMN1; SMN2MAPT
SCHEMBL9127303 0.91 KMT2A (0.61) ALDH1A1GAAHTTSMN1; SMN2MAPT
SCHEMBL9125722 0.88 ALDH1A1 (0.75) ALDH1A1GAAHTTSMN1; SMN2MAPT
SCHEMBL9127234 0.87 ALDH1A1 (0.59) ALDH1A1GAAHTTSMN1; SMN2MAPT
SCHEMBL9126383 0.86 CYP1A2 (0.59) ALDH1A1GAAMAPTKDM4EKMT2A
SCHEMBL9125277 0.86 KMT2A (0.66) ALDH1A1GAAHTTSMN1; SMN2MAPT
SCHEMBL6629567 0.86 RAB9A (0.68) ALDH1A1GAAHTTSMN1; SMN2MAPT
SCHEMBL9126941 0.85 PORCN (0.55) ALDH1A1GAAHTTSMN1; SMN2MAPT

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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