SCHEMBL30290989

SCHEMBL30290989

CCCCC/C=C\C/C=C\CCCCCCCCOC(C=O)C(OCCCCCCCC/C=C\C/C=C\CCCCC)N(C)C

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
CNR1 P21554 1/20 0.50
CNR2 P34972 1/20 0.50
TRPV1 Q8NER1 1/20 0.44

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
SCHEMBL170865 0.82 ALDH1A1 (0.54) ALDH1A1CNR1CNR2
SCHEMBL945677 0.82 ALDH1A1 (0.54) ALDH1A1CNR1CNR2
SCHEMBL1921025 0.81 ALDH1A1 (0.56) ALDH1A1CNR1CNR2
SCHEMBL251553 0.77 CNR1 (0.46) ALDH1A1CNR1CNR2TRPV1
SCHEMBL251555 0.77 CNR1 (0.46) ALDH1A1CNR1CNR2TRPV1
SCHEMBL18954218 0.76 ALDH1A1 (0.56) ALDH1A1CNR1CNR2
SCHEMBL31213151 0.76 ALDH1A1 (0.56) ALDH1A1CNR1CNR2
SCHEMBL21248542 0.74 ALDH1A1 (0.55) ALDH1A1CNR1CNR2
SCHEMBL20540819 0.74 ALDH1A1 (0.55) ALDH1A1CNR1CNR2
SCHEMBL15018073 0.74 ALDH1A1 (0.55) ALDH1A1CNR1CNR2

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-20230082584-A1 COMPOSITIONS AND METHODS FOR IDENTIFYING HOST CELL TARGET PROTEINS FOR TREATING RNA VIRUS INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-03-16 US disclosed