SCHEMBL7400741

SCHEMBL7400741

N=C(N)c1ccc(CCCC[C@@H]2C[C@H](c3ccccc3)CC(=O)O2)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F2 P00734 9/20 0.43
F10 P00742 3/20 0.43
PRKCA P17252 4/20 0.42
PRKCD Q05655 4/20 0.42
PRKCG P05129 2/20 0.40
PRKCB P05771 2/20 0.40
PRKCH P24723 2/20 0.40
PRKCE Q02156 2/20 0.40
PRKCQ Q04759 2/20 0.40
ITGB3 P05106 3/20 0.38
ITGA2B P08514 3/20 0.38

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
SCHEMBL7398691 1.00 F2 (0.43) F2F10PRKCAPRKCDPRKCG
SCHEMBL7396913 0.88 NAMPT (0.38) F2F10PRKCAPRKCDPRKCG
SCHEMBL7441500 0.88 NAMPT (0.38) F2F10PRKCAPRKCDPRKCG
SCHEMBL7396917 0.88 NAMPT (0.38) F2F10PRKCAPRKCDPRKCG
SCHEMBL7397351 0.84 PRKCA (0.40) PRKCAPRKCD
SCHEMBL7397347 0.84 PRKCA (0.40) PRKCAPRKCD
SCHEMBL7399030 0.84 PRKCA (0.40) PRKCAPRKCD
SCHEMBL7398589 0.82 PRKCA (0.41) F2PRKCAPRKCDPRKCGPRKCB
SCHEMBL7403999 0.82 PRKCA (0.41) F2PRKCAPRKCDPRKCGPRKCB
SCHEMBL7399033 0.82 PRKCA (0.41) F2PRKCAPRKCDPRKCGPRKCB

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 2 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
WO-1994000424-A1 PHENYL AMIDINE ALKANOIC ACIDS AND LACTONES USEFUL AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1994-01-06 WO disclosed