SCHEMBL7399119

SCHEMBL7399119

NN=Cc1ccc(CCCC[C@@H]2C[C@@H](c3ccccc3)CC(=O)O2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 4/20 0.40
PRKCD Q05655 4/20 0.40
PRKCG P05129 2/20 0.37
PRKCB P05771 2/20 0.37
PRKCH P24723 2/20 0.37
PRKCE Q02156 2/20 0.37
PRKCQ Q04759 2/20 0.37
CTRB1 P17538 1/20 0.34
GAA P10253 1/20 0.34
PLA2G6 O60733 2/20 0.32
PLA2G4A P47712 1/20 0.32
SIGMAR1 Q99720 2/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL7400445 1.00 PRKCA (0.40) PRKCAPRKCDPRKCGPRKCBPRKCH
SCHEMBL7441505 0.88 NAMPT (0.35) PRKCAPRKCDPRKCGPRKCBPRKCH
SCHEMBL7396921 0.88 NAMPT (0.35) PRKCAPRKCDPRKCGPRKCBPRKCH
SCHEMBL7397355 0.84 PRKCA (0.39) PRKCAPRKCD
SCHEMBL7404000 0.83 PRKCD (0.38) PRKCAPRKCDPRKCGPRKCBPRKCH
SCHEMBL7396167 0.82 PRKCA (0.38) PRKCAPRKCDPRKCGPRKCBPRKCH
SCHEMBL7398539 0.81 PRKCA (0.35) PRKCAPRKCDPRKCGPRKCBPRKCH
SCHEMBL7399372 0.80 PRKCA (0.37) PRKCAPRKCDPRKCGPRKCBPRKCH
SCHEMBL7398691 0.80 F2 (0.43) PRKCAPRKCDPRKCGPRKCBPRKCH
SCHEMBL7400741 0.80 F2 (0.43) PRKCAPRKCDPRKCGPRKCBPRKCH

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
WO-1994000424-A1 PHENYL AMIDINE ALKANOIC ACIDS AND LACTONES USEFUL AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1994-01-06 WO claimed
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