SCHEMBL4877054

SCHEMBL4877054

CCC=CCCC=CC=CC(=O)N(C)C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 5/20 0.58
CNR2 P34972 3/20 0.45
CNR1 P21554 2/20 0.45
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA4 P43681 1/20 0.39
OXER1 Q8TDS5 5/20 0.37
ALDH1A1 P00352 5/20 0.37
PPARG P37231 5/20 0.37
CYP19A1 P11511 4/20 0.37
MAPT P10636 3/20 0.37
RXRA P19793 2/20 0.37
FFAR1 O14842 2/20 0.37
PPARD Q03181 4/20 0.35
PTGS1 P23219 3/20 0.35
F7 P08709 3/20 0.35
F3 P13726 3/20 0.35
KMT2A Q03164 2/20 0.35
ADORA3 P0DMS8 1/20 0.35

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
SCHEMBL4877044 1.00 PPARA (0.58) PPARACNR2CNR1CHRNB2CHRNB4
SCHEMBL4191471 0.86 CHRNB2 (0.47) PPARACNR2CNR1CHRNB2CHRNB4
SCHEMBL18813838 0.86 CHRNB2 (0.47) PPARACNR2CNR1CHRNB2CHRNB4
SCHEMBL16658755 0.81 KDM4E (0.46) CNR2CNR1CHRNB2CHRNB4CHRNA3
SCHEMBL16658760 0.79 FASN (0.53) CNR2CNR1OXER1ALDH1A1MAPT
SCHEMBL16658757 0.78 FASN (0.56) CNR2CNR1ALDH1A1MAPTKDM4E
SCHEMBL16658759 0.78 FASN (0.56) CNR2CNR1ALDH1A1MAPTKDM4E
SCHEMBL16658758 0.78 FASN (0.56) CNR2CNR1ALDH1A1MAPTKDM4E
SCHEMBL17297096 0.78 FASN (0.56) CNR2CNR1ALDH1A1MAPTKDM4E
SCHEMBL16658756 0.78 FASN (0.56) CNR2CNR1ALDH1A1MAPTKDM4E

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
US-20080038386-A1 Use of a liquid cooling sensate to provide a pungent, warming or tingling sensate composition MOZA ASHOK K 2008-02-14 US disclosed