SCHEMBL13795285

SCHEMBL13795285

C=CN(CC1CC1(C)c1ccccc1)C(C)=O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 11/20 0.41
SLC6A4 P31645 9/20 0.41
SLC6A3 Q01959 5/20 0.40
LMNA P02545 2/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP2D6 P10635 1/20 0.39
HTR2C P28335 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MAPK1 P28482 1/20 0.38
OPRM1 P35372 1/20 0.36
OPRL1 P41146 1/20 0.36
CCR2 P41597 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
SCHEMBL13795235 0.87 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3LMNACYP2D6
SCHEMBL12511286 0.86 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL12511704 0.82 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3LMNAMAPT
SCHEMBL12512575 0.80 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3LMNAMAPT
SCHEMBL13795283 0.78 SLC6A3 (0.51) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL13795674 0.77 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3LMNAMAPT
SCHEMBL12512518 0.77 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3LMNAMAPT
SCHEMBL12511314 0.76 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL12511728 0.76 SLC6A3 (0.40) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL12512125 0.75 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3LMNAMAPT

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