SCHEMBL7394223

SCHEMBL7394223

COC(=O)C[C@H]1CC(=O)O[C@@H](CCCCc2ccc(C#N)cc2)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.38
PRKCA P17252 4/20 0.37
PRKCD Q05655 4/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
BRD4 O60885 1/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
PRKCG P05129 2/20 0.33
PRKCB P05771 2/20 0.33
PRKCH P24723 2/20 0.33
PRKCE Q02156 2/20 0.33
PRKCQ Q04759 2/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
PPARG P37231 1/20 0.33
EPHX2 P34913 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MTNR1A P48039 2/20 0.33
MTNR1B P49286 2/20 0.33

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
SCHEMBL7394225 1.00 GRM2 (0.38) GRM2PRKCAPRKCDTSHRHSD17B10
SCHEMBL7401295 0.83 F2 (0.38) PRKCAPRKCDBRD4
SCHEMBL7401296 0.83 F2 (0.38) PRKCAPRKCDBRD4
SCHEMBL7401650 0.81 GRM2 (0.42) GRM2PRKCAPRKCDTSHRHSD17B10
SCHEMBL7401646 0.81 GRM2 (0.42) GRM2PRKCAPRKCDTSHRHSD17B10
SCHEMBL7405665 0.81 GRM2 (0.42) GRM2PRKCAPRKCDTSHRHSD17B10
SCHEMBL7405668 0.81 GRM2 (0.42) GRM2PRKCAPRKCDTSHRHSD17B10
SCHEMBL7401654 0.81 GRM2 (0.42) GRM2PRKCAPRKCDTSHRHSD17B10
SCHEMBL7397474 0.81 GRM2 (0.42) GRM2PRKCAPRKCDTSHRHSD17B10
SCHEMBL7397468 0.81 GRM2 (0.42) GRM2PRKCAPRKCDTSHRHSD17B10

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