SCHEMBL11113500

SCHEMBL11113500

Cc1cccc(C)c1N(C(=O)C1(N)CCNCC1)C1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
SCN4A P35499 1/20 0.40
DPP9 Q86TI2 1/20 0.36
DPP7 Q9UHL4 1/20 0.36
OPRM1 P35372 7/20 0.35
TRPM8 Q7Z2W7 5/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTR2C P28335 2/20 0.33

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
SCHEMBL11117599 0.85 LMNA (0.43) LMNASCN4AOPRM1TRPM8SLC6A2
SCHEMBL11116215 0.78 SCN4A (0.39) LMNASCN4AOPRM1SLC6A2SLC6A4
SCHEMBL11111207 0.78 SCN4A (0.39) LMNASCN4AOPRM1SLC6A2SLC6A4
SCHEMBL11114169 0.78 OPRM1 (0.44) LMNAOPRM1
SCHEMBL11113548 0.77 SCN4A (0.39) LMNASCN4AOPRM1HTR2C
SCHEMBL11118690 0.76 DPP9 (0.40) SCN4ADPP9DPP7OPRM1TRPM8
SCHEMBL11115188 0.73 SCN4A (0.39) LMNASCN4AOPRM1
SCHEMBL11117393 0.73 SCN4A (0.39) LMNASCN4AOPRM1
SCHEMBL11116061 0.72 SCN4A (0.40) LMNASCN4AOPRM1HTR2C
SCHEMBL11116317 0.71 SCN4A (0.39) LMNASCN4AOPRM1

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