SCHEMBL7400783

SCHEMBL7400783

CC(C)=CCC[C@@H]1CC[C@H](O)C(=O)O1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.36
PGGT1B P53609 1/20 0.36
PPARG P37231 1/20 0.33
FNTB P49356 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NFE2L2 Q16236 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PKM P14618 1/20 0.31
F2 P00734 2/20 0.30
PRSS1 P07477 2/20 0.30

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
SCHEMBL9742360 0.76 PPARG (0.50) PPARGMEN1KMT2AALDH1A1
SCHEMBL9743417 0.76 PPARG (0.50) PPARGMEN1KMT2AALDH1A1
SCHEMBL6434393 0.75 FNTA (0.40) FNTAPGGT1BPPARGFNTBMEN1
SCHEMBL7399807 0.75 STAT3 (0.31)
SCHEMBL9665057 0.73 PPARG (0.58) PPARGALDH1A1
SCHEMBL9457080 0.73 PPARG (0.58) PPARGALDH1A1
SCHEMBL9457073 0.73 PPARG (0.58) PPARGALDH1A1
SCHEMBL9457070 0.73 PPARG (0.58) PPARGALDH1A1
SCHEMBL9742408 0.73 PPARG (0.58) PPARGALDH1A1
SCHEMBL9743833 0.73 PPARG (0.58) PPARGALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5646183-A Phenyl amidine alkanoic acids useful as platelet aggregation inhibitors G. D. SEARLE & CO. (US) 1997-07-08 US disclosed
US-5612355-A Phenyl amidine lactones useful as platelet aggregation inhibitors G. D. SEARLE & CO. (US) 1997-03-18 US disclosed
US-5504106-A Phenyl amidine alkanoic acids and lactones useful as platelet aggregation inhibitors G. D. SEARLE & CO. (US) 1996-04-02 US disclosed
WO-1994000424-A1 PHENYL AMIDINE ALKANOIC ACIDS AND LACTONES USEFUL AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1994-01-06 WO disclosed