SCHEMBL1948716

SCHEMBL1948716

C=CC(=O)ONC(=O)C(CCC)CCCCCC/C=C\C/C=C\CCCCC

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
SOAT1 P35610 1/20 0.45
CNR1 P21554 3/20 0.43
CNR2 P34972 1/20 0.43
TRPV1 Q8NER1 1/20 0.43

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
SCHEMBL1949922 0.96 CNR2 (0.41) KDM4ESOAT1CNR2TRPV1
SCHEMBL317295 0.96 CNR2 (0.41) KDM4ESOAT1CNR2TRPV1
SCHEMBL537660 0.94 ALDH1A1 (0.41) KDM4ESOAT1
SCHEMBL317594 0.90 TSHR (0.44)
SCHEMBL1951438 0.90 TSHR (0.44)
SCHEMBL1953135 0.90 TSHR (0.44)
SCHEMBL316780 0.89 CA1 (0.43) SOAT1CNR2TRPV1
SCHEMBL1955120 0.89 CA1 (0.43) SOAT1CNR2TRPV1
SCHEMBL1949874 0.89 CA1 (0.43) SOAT1CNR2TRPV1
SCHEMBL538090 0.86 ALDH1A1 (0.42) KDM4ESOAT1TRPV1

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-20110136975-A1 MONOMER MIXTURE, POLYMER, COATING MEANS AND METHOD FOR PRODUCING A COATING EVONIK ROEHM GMBH (DE) 2011-06-09 US disclosed