SCHEMBL91769

SCHEMBL91769

Cc1ccc(-c2ccc(-c3c(C)cc(C4CCC(C)CO4)cc3C)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.32
EBP Q15125 1/20 0.31
DHCR7 Q9UBM7 1/20 0.31
SLC12A2 P55011 1/20 0.30
SLC12A5 Q9H2X9 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL91780 0.90 CYP1A2 (0.32)
SCHEMBL91737 0.85 HSD11B1 (0.33)
SCHEMBL91738 0.85 HSD11B1 (0.37)
SCHEMBL20202903 0.85
SCHEMBL19500351 0.85
SCHEMBL13548355 0.84 TAS1R3 (0.32) MAOB
SCHEMBL91755 0.83
SCHEMBL91816 0.83 KMT2A (0.39) MAPT
SCHEMBL91713 0.82 HSD11B1 (0.38)
SCHEMBL14075364 0.82 PRKAG1 (0.31)

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-8129002-B2 Compounds for use in liquid crystal media MERCK PATENT GMBH (DE) 2012-03-06 US disclosed