SCHEMBL8871963

SCHEMBL8871963

Cc1ccccc1CC(Cc1ccccc1C)C(=O)Cl

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.48
PPARA Q07869 1/20 0.48
HPGD P15428 3/20 0.46
ALDH1A1 P00352 2/20 0.46
HTT P42858 1/20 0.42
CTBP2 P56545 1/20 0.42
KDM4E B2RXH2 2/20 0.41
EPHX2 P34913 1/20 0.41
DPP4 P27487 1/20 0.40
DPP7 Q9UHL4 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
LMNA P02545 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
MAOB P27338 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
SCHEMBL9419783 0.91 PPARG (0.49) PPARGPPARAHPGDALDH1A1HTT
SCHEMBL7438291 0.84 PPARA (0.40) PPARGPPARAHPGDALDH1A1HTT
SCHEMBL7621562 0.83 PPARG (0.47) PPARGPPARAHPGDALDH1A1HTT
SCHEMBL7384644 0.82 PPARG (0.57) PPARGPPARAHPGDALDH1A1HTT
SCHEMBL6688791 0.78 PPARG (0.49) PPARGPPARAHPGDALDH1A1HTT
SCHEMBL19502687 0.78 ALDH1A1 (0.47) PPARGPPARAALDH1A1EPHX2KMT2A
SCHEMBL11983359 0.78 PPARG (0.50) PPARGPPARAHPGDALDH1A1HTT
SCHEMBL27304316 0.78 PPARG (0.50) PPARGPPARAHPGDALDH1A1HTT
SCHEMBL7273958 0.78 PPARG (0.50) PPARGPPARAHPGDALDH1A1HTT
SCHEMBL9419792 0.78 PPARG (0.64) PPARGPPARAHPGDALDH1A1HTT

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-5610177-A Acylated amino acids as endothelin antagonists WARNER-LAMBERT COMPANY (US) 1997-03-11 US disclosed