SCHEMBL8892864

SCHEMBL8892864

COC(Oc1ccc(Cl)cc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.51
PPARG P37231 18/20 0.51
HPGD P15428 1/20 0.46
MEN1 O00255 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
MAPT P10636 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 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
SCHEMBL503845 0.88 PPARG (0.58) PPARAPPARG
SCHEMBL11729032 0.83 PPARA (0.56) PPARAPPARG
SCHEMBL1628567 0.82 GAA (0.47) PPARAPPARGHPGDMEN1CYP1A2
SCHEMBL5914738 0.81 TPMT (0.38) PPARAPPARG
SCHEMBL11112713 0.81 LDHA (0.45) PPARAPPARG
SCHEMBL10880775 0.79 ALDH1A3 (0.55) PPARAPPARGCYP1A2CYP2C19KMT2A
SCHEMBL7867822 0.79 PPARG (0.54) PPARAPPARG
SCHEMBL11641221 0.79 PPARG (0.61) PPARAPPARG
SCHEMBL11728381 0.79 PPARA (0.64) PPARAPPARG
SCHEMBL5925159 0.78 PPARG (0.59) PPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5643878-A TREATMENT OF RETROVIRAL DISEASES LIKE AIDS CIBA-GEIGY CORPORATION (US) 1997-07-01 US disclosed