SCHEMBL7864776

SCHEMBL7864776

CCC(Cc1cccc(CNC(=O)c2cccc(NC=NN)c2)c1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.53
EPHX2 P34913 4/20 0.52
PPARA Q07869 13/20 0.50
PPARD Q03181 4/20 0.50
LMNA P02545 1/20 0.45
BCHE P06276 1/20 0.43

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
SCHEMBL7863145 0.90 EPHX2 (0.54) PPARGEPHX2PPARAPPARDLMNA
SCHEMBL7864267 0.88 TP53 (0.45) PPARGLMNABCHE
SCHEMBL7862001 0.85 ITGB3 (0.48) LMNABCHE
SCHEMBL7861998 0.85 ITGB3 (0.48) LMNABCHE
SCHEMBL7864788 0.84 SIRT2 (0.44) PPARGEPHX2LMNA
SCHEMBL7856483 0.84 SIRT2 (0.48) PPARGEPHX2LMNA
SCHEMBL7457847 0.84 MEN1 (0.51) PPARGLMNA
SCHEMBL7377643 0.83 F10 (0.46) PPARGEPHX2LMNA
SCHEMBL7864170 0.82 EPHX2 (0.47) PPARGEPHX2LMNABCHE
SCHEMBL7864751 0.82 SIRT2 (0.41) PPARGLMNA

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
EP-0889877-B1 META-SUBSTITUTED PHENYLENE DERIVATIVES AND THEIR USE AS ALPHAvBETA3 INTEGRIN ANTAGONISTS OR INHIBITORS SEARLE & CO (US) 2001-08-29 EP claimed