SCHEMBL13795674

SCHEMBL13795674

CC(=O)N(CC1CC1(C)c1ccccc1)C(C)C

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.45
SLC6A3 Q01959 5/20 0.41
OPRM1 P35372 5/20 0.40
OPRL1 P41146 2/20 0.40
SLC6A4 P31645 3/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SIGMAR1 Q99720 2/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CCR2 P41597 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
CYP2D6 P10635 1/20 0.36
HTR2C P28335 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
SCHEMBL12511702 0.86 SLC6A2 (0.43) SLC6A2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL12511714 0.86 SLC6A2 (0.39) SLC6A2SLC6A3OPRM1SLC6A4SIGMAR1
SCHEMBL13796414 0.85 SLC6A2 (0.45) SLC6A2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL12512575 0.84 SLC6A2 (0.44) SLC6A2SLC6A3OPRM1OPRL1SLC6A4
SCHEMBL12512125 0.81 SLC6A2 (0.40) SLC6A2SLC6A3SLC6A4LMNAMAPT
SCHEMBL13795283 0.79 SLC6A3 (0.51) SLC6A2SLC6A3SLC6A4CYP2D6HTR2C
SCHEMBL12512518 0.78 SLC6A2 (0.47) SLC6A2SLC6A3OPRM1OPRL1SLC6A4
SCHEMBL12511314 0.77 SLC6A2 (0.49) SLC6A2SLC6A3SLC6A4CYP2D6HTR2C
SCHEMBL12511728 0.77 SLC6A3 (0.40) SLC6A2SLC6A3SLC6A4CYP2D6HTR2C
SCHEMBL13795285 0.77 SLC6A2 (0.41) SLC6A2SLC6A3OPRM1OPRL1SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1642886-B1 Saturated and unsaturated N-Alkamides exhibiting taste and flavor enhancement effect in flavor compositions INT FLAVORS & FRAGRANCES INC (US) 2016-11-16 EP disclosed
US-7541055-B2 Saturated and unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2009-06-02 US disclosed
US-7541055-B2 Saturated and unsaturated N-alkamides exhibiting taste and flavor enhancement effect in flavor compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2009-06-02 US disclosed