SCHEMBL9024697

SCHEMBL9024697

COc1ccc(NC(=O)OCCCl)c(OC)c1O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 2/20 0.41
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
MAPT P10636 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
EGFR P00533 1/20 0.37
KDR P35968 1/20 0.37
MEN1 O00255 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL9793328 0.86 L3MBTL1 (0.42) L3MBTL1NPSR1ALDH1A1LMNATSHR
SCHEMBL5656282 0.77 KMT2A (0.67) L3MBTL1NPSR1ALDH1A1TSHRKMT2A
SCHEMBL9024693 0.77 MAPT (0.38) LMNAKMT2ACYP1A2CYP2C19MAPT
SCHEMBL9023932 0.76 ALDH1A1 (0.53) ALDH1A1TSHRKMT2ACYP1A2MAPT
SCHEMBL18033044 0.75 ALDH1A1 (0.52) L3MBTL1NPSR1ALDH1A1LMNATSHR
SCHEMBL5162101 0.74 ALDH1A1 (0.43) L3MBTL1NPSR1ALDH1A1LMNATSHR
SCHEMBL9024098 0.73 LMNA (0.47) L3MBTL1NPSR1ALDH1A1LMNATSHR
SCHEMBL5162158 0.72 ALDH1A1 (0.41) L3MBTL1NPSR1ALDH1A1LMNATSHR
SCHEMBL11219009 0.71 CXCR2 (0.47) L3MBTL1NPSR1ALDH1A1LMNATSHR
SCHEMBL9126631 0.71 ALDH1A1 (0.49) L3MBTL1ALDH1A1TSHRKMT2ACYP1A2

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-0591373-B1 META-AMINOPHENOLS, THEIR USE AS COUPLERS FOR OXIDATION DYEING OF KERATINOUS FIBRES, DYE COMPOSITIONS AND METHOD OREAL (FR) 1996-05-22 EP disclosed
US-5443596-A Keratinous fiber dyeing compositions and processes utilizing oxidation dye precursors in combination with dimethoxy meta-aminophenol couplers L'OREAL (FR) 1995-08-22 US disclosed
EP-0591373-A1 META-AMINOPHENOLS, THEIR USE AS COUPLERS FOR OXIDATION DYEING OF KERATINOUS FIBRES, DYE COMPOSITIONS AND METHOD. OREAL (FR) 1994-04-13 EP disclosed
WO-1993000066-A1 META-AMINOPHENOLS, THEIR USE AS COUPLERS FOR OXIDATION DYEING OF KERATINOUS FIBRES, DYE COMPOSITIONS AND METHOD L'OREAL (FR) 1993-01-07 WO disclosed