SCHEMBL9019928

SCHEMBL9019928

CCC1CCC(OCc2ccc(-c3ccc(-c4ccc(C5CO5)c(F)c4F)cc3)c(F)c2F)CC1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.34

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
SCHEMBL13586565 0.89 HTR1A (0.35) HTR1A
SCHEMBL9021615 0.84 CHKA (0.30)
SCHEMBL12821336 0.83 FFAR4 (0.34) HTR1A
SCHEMBL12719134 0.83 NAAA (0.35) HTR1A
SCHEMBL9020647 0.82 ALDH1A1 (0.34)
SCHEMBL8970707 0.81 NAAA (0.42) HTR1A
SCHEMBL12822230 0.81 HTR1A (0.32) HTR1A
SCHEMBL12822941 0.81 HTR1A (0.30) HTR1A
SCHEMBL9020686 0.81
SCHEMBL4419696 0.80 ESR2 (0.33)

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-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed