SCHEMBL7384644

SCHEMBL7384644

Cc1ccccc1CC(Cc1ccccc1C)C(=O)O

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.57
CYP1A2 P05177 1/20 0.55
PPARA Q07869 1/20 0.53
HPGD P15428 2/20 0.51
ALDH1A1 P00352 1/20 0.51
HTT P42858 1/20 0.47
CTBP2 P56545 1/20 0.47
FOLH1 Q04609 2/20 0.45
EPHX2 P34913 1/20 0.45
CPA1 P15085 2/20 0.44
CPA3 P15088 2/20 0.44
CPB1 P15086 1/20 0.44
CPB2 Q96IY4 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
SCHEMBL9419792 0.94 PPARG (0.64) PPARGCYP1A2PPARAHPGDALDH1A1
SCHEMBL7273958 0.91 PPARG (0.50) PPARGCYP1A2PPARAHPGDALDH1A1
SCHEMBL27304316 0.91 PPARG (0.50) PPARGCYP1A2PPARAHPGDALDH1A1
SCHEMBL7299030 0.89 CPA1 (0.61) PPARGCYP1A2PPARAHPGDALDH1A1
SCHEMBL27784429 0.86 CPA3 (0.63) PPARGCYP1A2PPARAHPGDALDH1A1
SCHEMBL7437418 0.86 KMT2A (0.58) PPARGPPARAHPGDALDH1A1HTT
SCHEMBL28005647 0.85 PPARG (0.54) PPARGPPARAHPGDALDH1A1CTBP2
SCHEMBL7382016 0.85 PPARG (0.48) PPARGCYP1A2PPARAHPGDALDH1A1
SCHEMBL7367331 0.84 PPARG (0.45) PPARGCYP1A2PPARAHPGDALDH1A1
SCHEMBL7367328 0.84 PPARG (0.45) PPARGCYP1A2PPARAHPGDALDH1A1

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
US-5610177-A Acylated amino acids as endothelin antagonists WARNER-LAMBERT COMPANY (US) 1997-03-11 US disclosed
US-4870183-A RENIN INHIBITORS, HYPOTENSIVES KISSEI PHARMACEUTICAL CO., LTD. (JP) 1989-09-26 US disclosed
EP-0252727-A1 Novel amino acid derivatives Kissei Pharmaceutical Co. Ltd. (JP) 1988-01-13 EP disclosed