SCHEMBL29199916

SCHEMBL29199916

CCCCC=Cc1cc(C=CCCCC)c(O)c(C=CCCCC)c1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 1/20 0.43
▸ OPRD1 P41143 1/20 0.36
▸ OPRM1 P35372 1/20 0.36
▸ TNNC1 P63316 1/20 0.35
▸ CNR1 P21554 1/20 0.34
▸ TRPV1 Q8NER1 1/20 0.32
▸ CYSLTR2 Q9NS75 2/20 0.32
▸ CYSLTR1 Q9Y271 2/20 0.32

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
SCHEMBL545383 0.82 OPRM1 (0.46) OPRM1TNNC1TRPV1
SCHEMBL545384 0.82 OPRM1 (0.46) OPRM1TNNC1TRPV1
SCHEMBL7645028 0.81 LCK (0.44) PDE5A
SCHEMBL2030815 0.81 LCK (0.50) —
SCHEMBL2030814 0.81 LCK (0.50) —
SCHEMBL14998897 0.80 EGFR (0.48) OPRD1OPRM1TNNC1
SCHEMBL10296725 0.76 LCK (0.48) TNNC1TRPV1
SCHEMBL28995072 0.75 OPRM1 (0.46) OPRD1OPRM1TNNC1CNR1TRPV1
SCHEMBL17938807 0.74 PTGS2 (0.48) TNNC1
SCHEMBL11296041 0.74 PTGS2 (0.48) TNNC1

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
CN-113166339-B Curable resin composition, fuel cell, and sealing method 三键有限公司 2024-03-19 — — CN disclosed
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