SCHEMBL8941437

SCHEMBL8941437

C=CCOc1ccc(-c2ccc(-c3ccc(C4CCC(CCCCCCC)CO4)c(F)c3)cc2)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.30
HTR2A P28223 1/20 0.30
HTR2B P41595 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
SCHEMBL8940940 0.99 HTR2C (0.31) HTR2CHTR2AHTR2B
SCHEMBL8940764 0.93 HTR2C (0.32) HTR2CHTR2AHTR2B
SCHEMBL18718323 0.93 HTR2C (0.32) HTR2CHTR2AHTR2B
SCHEMBL8941060 0.92 GRIN1 (0.33)
SCHEMBL8932646 0.92 GRIN1 (0.33)
SCHEMBL8941129 0.91 PTPN11 (0.35)
SCHEMBL8941126 0.91 PTPN11 (0.35)
SCHEMBL8941370 0.91 PTPN11 (0.33)
SCHEMBL8941390 0.91 PTPN11 (0.35)
SCHEMBL8940982 0.91 PTPN11 (0.35)

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