SCHEMBL7345190

SCHEMBL7345190

CC1=C(c2ccc(F)cc2)CNC1=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 1/20 0.43
▸ PTGS1 P23219 9/20 0.42
▸ DAPK3 O43293 1/20 0.40
▸ NTRK1 P04629 1/20 0.40
▸ PIM1 P11309 1/20 0.40
▸ FLT3 P36888 1/20 0.40
▸ GSK3B P49841 1/20 0.40
▸ ROCK1 Q13464 1/20 0.40
▸ CLK4 Q9HAZ1 1/20 0.40
▸ MAPK14 Q16539 2/20 0.38
▸ PTGS2 P35354 6/20 0.38
▸ GRM5 P41594 1/20 0.37
▸ MGAT2 Q10469 1/20 0.36
▸ TNKS2 Q9H2K2 1/20 0.36
▸ PARP1 P09874 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ POLB P06746 1/20 0.35

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
SCHEMBL7342203 0.77 GRM2 (0.40) GRM2PTGS1DAPK3NTRK1PIM1
SCHEMBL11091670 0.74 PTGS1 (0.57) GRM2PTGS1FLT3CLK4MAPK14
SCHEMBL11083302 0.74 PTGS1 (0.57) GRM2PTGS1FLT3CLK4MAPK14
SCHEMBL7344047 0.71 PDE3B (0.54) —
SCHEMBL7341161 0.71 PDE3B (0.54) —
SCHEMBL11086876 0.70 PTGS1 (0.44) GRM2PTGS1FLT3MAPK14PTGS2
SCHEMBL18593200 0.68 JAK2 (0.31) —
SCHEMBL34460999 0.66 CLK4 (0.52) GRM2PTGS1DAPK3NTRK1PIM1
SCHEMBL29984992 0.64 CLK4 (0.73) GRM2DAPK3NTRK1PIM1FLT3
SCHEMBL28223904 0.64 PIK3CD (0.64) GRM2NTRK1PIM1FLT3GSK3B

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
EP-0329691-B1 CARDIOTONIC IMIDAZOLYLPHENYLPYRROL-2-ONES SCHERING AKTIENGESELLSCHAFT (DE) 1991-11-21 — — EP disclosed
EP-0329691-A1 CARDIOTONIC IMIDAZOLYLPHENYLPYRROL-2-ONES. SCHERING AG (DE) 1989-08-30 — — EP disclosed
WO-1988003531-A1 CARDIOTONIC IMIDAZOLYLPHENYLPYRROL-2-ONES SCHERING AKTIENGESELLSCHAFT (DE) 1988-05-19 — — WO disclosed
US-4737511-A Cardiotonic imidazolylphenylpyrrol-2-ones SCHERING A.G. (DE) 1988-04-12 — — US disclosed
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