SCHEMBL7413009

SCHEMBL7413009

CCC(Oc1ccc(CO)cc1)C(=O)OC

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.51
PPARA Q07869 11/20 0.51
SMN1; SMN2 Q16637 1/20 0.43
TSHR P16473 2/20 0.42
KLK7 P49862 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
AR P10275 1/20 0.39
POLB P06746 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL8450043 0.87 PPARG (0.51) PPARGPPARASMN1; SMN2TSHRCYP1A2
SCHEMBL12220660 0.83 SMN1; SMN2 (0.49) PPARGPPARASMN1; SMN2TSHRCYP1A2
SCHEMBL6765131 0.83 MIF (0.48) PPARGPPARASMN1; SMN2TSHRCYP1A2
SCHEMBL14378432 0.83 MIF (0.48) PPARGPPARASMN1; SMN2TSHRCYP1A2
SCHEMBL2891961 0.83 PPARG (0.67) PPARGPPARASMN1; SMN2
SCHEMBL13433920 0.83 ALDH1A1 (0.45) PPARGPPARASMN1; SMN2TSHRALDH1A1
SCHEMBL21129084 0.82 CYP1A2 (0.56) PPARGPPARATSHRKLK7CYP1A2
SCHEMBL25997018 0.82 CYP1A2 (0.56) PPARGPPARATSHRKLK7CYP1A2
SCHEMBL8449775 0.82 PPARG (0.53) PPARGPPARASMN1; SMN2POLB
SCHEMBL9128983 0.82 PPARG (0.74) PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1173415-A1 DIPHENYLUREA DERIVATIVES AstraZeneca AB (SE) 2002-01-23 EP disclosed
WO-2000064866-A1 DIPHENYLUREA DERIVATIVES ASTRAZENECA AB (SE) 2000-11-02 WO disclosed