SCHEMBL20034084

SCHEMBL20034084

C=C[C@H](OCc1ccccc1)[C@@H](/C=C\C=C\C)OCc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RCE1 Q9Y256 1/20 0.35
TSHR P16473 1/20 0.33
SLC1A3 P43003 2/20 0.33
SLC1A2 P43004 2/20 0.33
SLC1A1 P43005 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
IDO1 P14902 1/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL16308018 0.89 RCE1 (0.38) RCE1TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL16308017 0.87 RCE1 (0.37) RCE1TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL17679382 0.80 RCE1 (0.39) RCE1TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL20582755 0.79 FAAH (0.45) MEN1KMT2A
SCHEMBL16308013 0.79 FAAH (0.45) MEN1KMT2A
SCHEMBL16291884 0.78 MEN1 (0.44) TSHRMEN1KMT2ACA7CA9
SCHEMBL16308015 0.78 MAOB (0.44) RCE1TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL20034060 0.78 MEN1 (0.44) TSHRMEN1KMT2ACA7CA9
SCHEMBL16291883 0.78 MEN1 (0.44) TSHRMEN1KMT2ACA7CA9
SCHEMBL22297643 0.78 RCE1 (0.41) RCE1TSHRSLC1A3SLC1A2SLC1A1

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-9938253-B2 Catalysts for efficient Z-selective metathesis TRUSTEES OF BOSTON COLLEGE (US) 2018-04-10 US disclosed