SCHEMBL7477635

SCHEMBL7477635

O=C(O)c1ccc(-c2ccc3c(ccn3Cc3ccccc3C(=O)O)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.52
SERPINE1 P05121 3/20 0.49
TSHR P16473 1/20 0.45
NTSR1 P30989 1/20 0.44
GLO1 Q04760 1/20 0.42

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
SCHEMBL7477006 0.89 SERPINE1 (0.51) PPARGSERPINE1NTSR1
SCHEMBL7482851 0.87 PPARG (0.51) PPARGSERPINE1NTSR1
SCHEMBL14233800 0.84 PPARG (0.70) PPARG
SCHEMBL7524721 0.80 KMT2A (0.57)
SCHEMBL7475482 0.80 POLB (0.44) PPARGSERPINE1TSHR
SCHEMBL7473999 0.79 PPARG (0.49) PPARGTSHR
SCHEMBL27583578 0.79 SERPINE1 (0.41) PPARGSERPINE1NTSR1
SCHEMBL28566467 0.79 PLAU (0.56) PPARG
SCHEMBL28565969 0.79 PPARG (0.53) PPARGTSHR
SCHEMBL14121203 0.79 PPARG (0.50) PPARG

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