SCHEMBL9544313

SCHEMBL9544313

COC(=O)CN(CC(=O)c1ccccc1)C(=O)[C@H]1Cc2ccccc2N1C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
OPRM1 P35372 1/20 0.39
OPRL1 P41146 1/20 0.39

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
SCHEMBL9543998 0.91 OPRM1 (0.41) OPRM1OPRL1
SCHEMBL9542891 0.87 CTSL (0.39) OPRM1OPRL1
SCHEMBL9544945 0.86 ACE (0.39)
SCHEMBL9543652 0.85 ACE (0.38)
SCHEMBL9543787 0.82 OPRM1 (0.36) OPRM1OPRL1
SCHEMBL9544364 0.81 DRD4 (0.45)
SCHEMBL9545334 0.81 ALDH1A1 (0.48) LMNA
SCHEMBL9542696 0.81 LMNA (0.42) LMNAOPRM1OPRL1
SCHEMBL9543297 0.81 DRD2 (0.38) LMNA
SCHEMBL9542586 0.79 LMNA (0.41) LMNA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993020099-A2 CCK AND/OR GASTRIN RECEPTOR LIGANDS FERRING B.V. (NL) 1993-10-14 WO disclosed