SCHEMBL4081238

SCHEMBL4081238

CN(C)C1(c2cccs2)CC[CH]CC1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 12/20 0.65
OPRL1 P41146 12/20 0.65
SLC6A3 Q01959 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.38
MEN1 O00255 1/20 0.38
PRCP P42785 1/20 0.38
KMT2A Q03164 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL3409128 0.83 OPRM1 (0.67) OPRM1OPRL1SLC6A3SLC6A2SLC6A4
SCHEMBL17443464 0.80 OPRM1 (0.63) OPRM1OPRL1SLC6A3SLC6A2SLC6A4
SCHEMBL2839265 0.80 OPRM1 (0.63) OPRM1OPRL1SLC6A3SLC6A2
Hydrochloric Acid SCHEMBL2339996 0.79 OPRM1 (0.61) OPRM1OPRL1SLC6A3SLC6A2
SCHEMBL517361 0.79 OPRM1 (0.61) OPRM1OPRL1SLC6A3LMNATSHR
SCHEMBL3407373 0.79 OPRL1 (1.00) OPRM1OPRL1
SCHEMBL4076511 0.77 OPRL1 (0.59) OPRM1OPRL1SLC6A3SLC6A2SLC6A4
SCHEMBL20866603 0.77 OPRL1 (0.59) OPRM1OPRL1SLC6A3SLC6A2
Ethylene SCHEMBL11099442 0.76 OPRM1 (0.58) OPRM1OPRL1SLC6A3LMNATSHR
SCHEMBL3932959 0.76 OPRM1 (0.62) OPRM1OPRL1SLC6A3

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-1745010-B1 SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES GRUENENTHAL GMBH (DE) 2009-08-05 EP claimed