SCHEMBL31442491

SCHEMBL31442491

CCCCC/C=C\C/C=C\CCCCCCCCOc1cc(CCCCCCCCCCCCCCC)cc(OCCO)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 10/20 0.51
▸ CNR2 P34972 8/20 0.51
▸ PPARA Q07869 1/20 0.50
▸ MGLL Q99685 1/20 0.49
▸ MEN1 O00255 1/20 0.48
▸ USP2 O75604 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ CASP1 P29466 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ SLCO1B3 Q9NPD5 1/20 0.48
▸ SLCO1B1 Q9Y6L6 1/20 0.48

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
SCHEMBL16013182 0.93 CNR1 (0.49) CNR1CNR2PPARAMGLLALDH1A1
SCHEMBL16013183 0.93 CNR1 (0.49) CNR1CNR2PPARAMGLLALDH1A1
SCHEMBL16013719 0.92 MGLL (0.48) CNR1CNR2MGLLALDH1A1
SCHEMBL16013720 0.92 MGLL (0.48) CNR1CNR2MGLLALDH1A1
SCHEMBL31442661 0.89 CNR1 (0.60) CNR1CNR2MEN1USP2ALDH1A1
SCHEMBL31442685 0.89 CNR1 (0.60) CNR1CNR2MEN1USP2ALDH1A1
SCHEMBL16154800 0.86 ALDH1A1 (0.50) CNR1CNR2PPARAMGLLALDH1A1
SCHEMBL17685832 0.86 ALDH1A1 (0.50) CNR1CNR2PPARAMGLLALDH1A1
SCHEMBL16013164 0.83 CNR1 (0.44) CNR1CNR2PPARA
SCHEMBL16013165 0.83 CNR1 (0.44) CNR1CNR2PPARA

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
WO-2025062315-A2 METHODS OF VALORISING CASHEW NUT SHELL LIQUID (CNSL) AND/OR A COMPONENT THEREOF UNIVERSITY OF THE WITWATERSRAND, JOHANNESBURG (ZA) 2025-03-27 — — WO disclosed
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