SCHEMBL7472435

SCHEMBL7472435

CCOC(=O)c1ccccc1Cc1[nH]c2ccc(O)cc2c1C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 12/20 0.64
GAA P10253 3/20 0.54
KDM4E B2RXH2 3/20 0.54
MEN1 O00255 2/20 0.54
ALDH1A1 P00352 2/20 0.54
MAPT P10636 2/20 0.54
KMT2A Q03164 2/20 0.54
LMNA P02545 1/20 0.54
HPGD P15428 1/20 0.54
MAPK10 P53779 1/20 0.54
HSD17B10 Q99714 1/20 0.54
HCRTR1 O43613 2/20 0.45
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA7 P43166 2/20 0.45
CA9 Q16790 2/20 0.45
CA14 Q9ULX7 2/20 0.45
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL7476207 0.84 GABRA1 (0.58) ALOX5GAAKDM4EMEN1ALDH1A1
SCHEMBL7478300 0.81 GABRA1 (0.52) ALOX5GAAKDM4EMEN1ALDH1A1
SCHEMBL7477511 0.78 ALOX5 (0.48) ALOX5GAAKDM4EMEN1ALDH1A1
SCHEMBL3985463 0.75 KDM4E (0.71) ALOX5GAAKDM4EMEN1ALDH1A1
SCHEMBL7826782 0.74 ALOX5 (0.81) ALOX5GAAKDM4EMEN1ALDH1A1
SCHEMBL25904050 0.73 GAA (0.53) ALOX5GAAKDM4EMEN1ALDH1A1
SCHEMBL7826833 0.73 GAA (0.75) ALOX5GAAKDM4EMEN1ALDH1A1
SCHEMBL6796057 0.71 ALOX5 (0.76) ALOX5GAAKDM4EMEN1ALDH1A1
SCHEMBL3988373 0.71 KDM4E (0.68) ALOX5GAAKDM4EMEN1ALDH1A1
SCHEMBL28750014 0.70 TSHR (0.50) GAAKDM4EMEN1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1379774-A Compounds ASTRAZENECA AB (SE) 2002-11-13 CN disclosed
EP-1210343-A2 BENZOIC ACID DERIVATIVES AND THEIR USE AS PPAR RECEPTOR AGONISTS AstraZeneca AB (SE) 2002-06-05 EP disclosed
WO-2001012187-A2 BENZOIC ACID DERIVATIVES AND THEIR USE AS PPAR RECEPTOR AGONISTS ASTRAZENECA AB (SE) 2001-02-22 WO disclosed