SCHEMBL764675

SCHEMBL764675

CC(C)(C)OC(=O)NC1CNC(=O)C[C@@H]1c1cc(F)ccc1F

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 17/20 0.53
FPR2 P25090 12/20 0.53
NTRK1 P04629 2/20 0.40
EPHX2 P34913 1/20 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
SCHEMBL12284238 1.00 FPR1 (0.53) FPR1FPR2NTRK1EPHX2
SCHEMBL12665952 1.00 FPR1 (0.53) FPR1FPR2NTRK1EPHX2
SCHEMBL19988711 0.91 FPR1 (0.61) FPR1FPR2EPHX2
SCHEMBL764604 0.88 FPR1 (0.47) FPR1FPR2EPHX2
SCHEMBL12284519 0.88 FPR1 (0.47) FPR1FPR2EPHX2
SCHEMBL12665948 0.88 FPR1 (0.47) FPR1FPR2EPHX2
SCHEMBL146484 0.85 KDM1A (0.40) FPR1FPR2NTRK1EPHX2
SCHEMBL146483 0.85 KDM1A (0.40) FPR1FPR2NTRK1EPHX2
SCHEMBL146482 0.85 KDM1A (0.40) FPR1FPR2NTRK1EPHX2
SCHEMBL2410790 0.85 FPR1 (0.60) FPR1FPR2

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-1921917-B1 FUSED AMINOPIPERIDINES AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES MERCK SHARP & DOHME (US) 2012-03-21 EP disclosed
EP-1819674-B1 FUSED AMINOPIPERIDINES AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES MERCK SHARP & DOHME (US) 2011-10-05 EP disclosed
WO-2007024993-A2 FUSED AMINOPIPERIDINES AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES MERCK & CO., INC. (US) 2007-03-01 WO disclosed
WO-2006058064-A2 FUSED AMINOPIPERIDINES AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES MERCK & CO., INC. (US) 2006-06-01 WO disclosed