SCHEMBL9126567

SCHEMBL9126567

CC(C)(c1ccc(O)cc1)c1ccc(OC(=O)Nc2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.61
GAA P10253 4/20 0.61
HTT P42858 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
RAB9A P51151 1/20 0.57
MAPT P10636 5/20 0.56
KDM4E B2RXH2 4/20 0.56
THRB P10828 2/20 0.56
GFER P55789 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
GLA P06280 1/20 0.56
BLM P54132 1/20 0.56
CASP6 P55212 1/20 0.56
KMT2A Q03164 4/20 0.54
USP2 O75604 1/20 0.54
ESR1 P03372 1/20 0.53
CYP3A4 P08684 1/20 0.53
ESR2 Q92731 1/20 0.53
MEN1 O00255 3/20 0.52
LMNA P02545 1/20 0.52

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
SCHEMBL9124673 0.96 MAPT (0.58) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9124905 0.94 ALDH1A1 (0.61) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9187129 0.93 ALDH1A1 (0.67) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9126941 0.92 PORCN (0.55) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9123589 0.92 SMN1; SMN2 (0.57) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9125614 0.92 PORCN (0.55) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9126667 0.90 ALDH1A1 (0.60) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9127604 0.90 ELANE (0.53) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9123549 0.90 ELANE (0.53) ALDH1A1GAAHTTSMN1; SMN2RAB9A
SCHEMBL9126529 0.88 CYP1A2 (0.56) 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