SCHEMBL27124679

SCHEMBL27124679

CCCCCCCCC=CC=CC=COCOC.[MgH2]

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.48
FASN P49327 1/20 0.43
FAAH O00519 8/20 0.38
TRPV1 Q8NER1 1/20 0.38
KDM4E B2RXH2 1/20 0.37
CNR1 P21554 3/20 0.36
CNR2 P34972 3/20 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
SCHEMBL27126037 0.98 ALDH1A1 (0.50) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL29801150 0.96 ALDH1A1 (0.47) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL20536818 0.96 ALDH1A1 (0.47) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL28635750 0.85 FAAH (0.43) FAAHTRPV1
SCHEMBL31106218 0.85 FAAH (0.43) FAAHTRPV1
SCHEMBL28728089 0.85 FAAH (0.43) FAAHTRPV1
SCHEMBL31106158 0.85 FAAH (0.43) FAAHTRPV1
SCHEMBL8674217 0.79 ALDH1A1 (0.53) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL8674220 0.79 ALDH1A1 (0.53) ALDH1A1TSHRFASNFAAHTRPV1
SCHEMBL28265145 0.78 TSHR (0.73) ALDH1A1TSHRFASNFAAHTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4291169-A1 NOVEL METHOD FOR MANUFACTURING TOMATO LEAFMINER PHEROMONE COMPONENTS Melchior Material And Life Science France (FR) 2023-12-20 EP disclosed
WO-2022171965-A1 NOVEL METHOD FOR MANUFACTURING TOMATO LEAFMINER PHEROMONE COMPONENTS MELCHIOR MATERIAL AND LIFE SCIENCE FRANCE (FR) 2022-08-18 WO disclosed