SCHEMBL6976928

SCHEMBL6976928

CC(C)(C)OC(=O)c1cccnc1NCC(=O)N1CCC(Oc2ccncc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SCD O00767 20/20 0.54

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
SCHEMBL6984405 0.87 SCD (0.50) SCD
SCHEMBL6985709 0.80 SIGLEC9 (0.45) SCD
SCHEMBL6983386 0.77 SCD (0.49) SCD
SCHEMBL6346657 0.76 SCD (0.56) SCD
SCHEMBL6344009 0.76 SCD (0.60) SCD
SCHEMBL6982506 0.75 SCD (0.47) SCD
SCHEMBL6346087 0.74 SCD (0.51) SCD
SCHEMBL4713304 0.73 GPR119 (0.62)
SCHEMBL6354873 0.72 EPHX2 (0.44) SCD
SCHEMBL6981269 0.71 SCD (0.52) SCD

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
EP-1289950-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2003-03-12 EP disclosed
WO-2001096296-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2001-12-20 WO disclosed