SCHEMBL11115485

SCHEMBL11115485

Cc1cccc(C)c1N(C(=O)C1(N(C)C)CCNCC1)[C@@H]1CCC[C@H]1NCCO

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 1/20 0.34
OPRM1 P35372 1/20 0.32
LMNA P02545 1/20 0.30

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
SCHEMBL11119011 0.87 SCN4A (0.36) SCN4AOPRM1LMNA
SCHEMBL11121131 0.87 IKZF2 (0.37) SCN4AOPRM1
SCHEMBL11118999 0.85 SCN4A (0.37) SCN4AOPRM1LMNA
SCHEMBL11117393 0.81 SCN4A (0.39) SCN4AOPRM1LMNA
SCHEMBL11116061 0.80 SCN4A (0.40) SCN4AOPRM1LMNA
SCHEMBL11114296 0.80 SSTR3 (0.38) SCN4AOPRM1
SCHEMBL11116317 0.79 SCN4A (0.39) SCN4AOPRM1LMNA
SCHEMBL10500113 0.79 SCN4A (0.39) SCN4AOPRM1LMNA
SCHEMBL11117599 0.79 LMNA (0.43) SCN4AOPRM1LMNA
SCHEMBL11115188 0.79 SCN4A (0.39) SCN4AOPRM1LMNA

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
EP-0121972-A2 N-aryl-alpha-amino-carboxamides JANSSEN PHARMACEUTICA N.V. (BE) 1984-10-17 EP disclosed