SCHEMBL92009

SCHEMBL92009

CCCOc1cc([C@H]2CCC(CCC)CO2)cc(F)c1-c1cc(F)c(CF)c(F)c1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 8/20 0.32
FASN P49327 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
SCHEMBL92005 0.96 PTAFR (0.33) PTAFRFASN
SCHEMBL91881 0.96 PTAFR (0.33) PTAFRFASN
SCHEMBL91928 0.96 PTAFR (0.33) PTAFRFASN
SCHEMBL91926 0.90 FASN (0.30) FASN
SCHEMBL91932 0.85 ADRB2 (0.31)
SCHEMBL91842 0.83 HTR1A (0.35) FASN
SCHEMBL84198 0.82
SCHEMBL91840 0.81 FASN (0.35) PTAFRFASN
SCHEMBL83414 0.78
SCHEMBL84086 0.78

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 2 patents. 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
US-7531106-B2 Mesogenic compounds, medium for electro-optical displays and electro-optical display MERCK PATENT GMBH (DE) 2009-05-12 US disclosed