SCHEMBL2369461

SCHEMBL2369461

C/C=C/CC/C=C/CCC=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.40
TRPV1 Q8NER1 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HIF1A Q16665 1/20 0.37
TSHR P16473 2/20 0.36
MAPK1 P28482 2/20 0.35
TRPA1 O75762 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
PPARG P37231 1/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
HPGD P15428 1/20 0.30

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
SCHEMBL2369464 1.00 FAAH (0.40) FAAHTRPV1ALDH1A1HIF1ATSHR
SCHEMBL29475612 1.00 FAAH (0.40) FAAHTRPV1ALDH1A1HIF1ATSHR
SCHEMBL1178828 0.97
SCHEMBL64596 0.97
SCHEMBL258908 0.97
SCHEMBL9126784 0.92 TRPV1 (0.46) FAAHTRPV1ALDH1A1HIF1ATSHR
SCHEMBL9126791 0.92 TRPV1 (0.46) FAAHTRPV1ALDH1A1HIF1ATSHR
SCHEMBL87783 0.92 TRPV1 (0.46) FAAHTRPV1ALDH1A1HIF1ATSHR
SCHEMBL22191498 0.86 HIF1A (0.53) FAAHTRPV1ALDH1A1HIF1ATSHR
SCHEMBL18076299 0.86 FAAH (0.58) FAAHTRPV1HIF1ATSHRPPARG

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-2364186-A2 PHOTOLABILE FRAGRANCE STORAGE SUBSTANCES Henkel AG & Co. KGaA (DE) 2011-09-14 EP claimed