SCHEMBL8962834

SCHEMBL8962834

C=CCOc1ccc(-c2ccc(-c3ccc(C4CCC(C5CCC(CCCCCC)CC5)CC4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.32
HTR2A P28223 2/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
HTR2B P41595 2/20 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
SCHEMBL8962924 1.00 HTR2C (0.32) HTR2CHTR2AGAAMAPTHTR2B
SCHEMBL8963378 1.00 HTR2C (0.32) HTR2CHTR2AGAAMAPTHTR2B
SCHEMBL8935564 0.97 HTR2C (0.34) HTR2CHTR2AGAAMAPTHTR2B
SCHEMBL8935665 0.97 HTR2C (0.34) HTR2CHTR2AGAAMAPTHTR2B
SCHEMBL8935430 0.97 HTR2C (0.34) HTR2CHTR2AGAAMAPTHTR2B
SCHEMBL8962413 0.96 HTR2C (0.33) HTR2CHTR2AHTR2B
SCHEMBL8935162 0.93 HTR2C (0.35) HTR2CHTR2AHTR2B
SCHEMBL19985308 0.93 HTR2C (0.36) HTR2CHTR2AGAAMAPTHTR2B
SCHEMBL19985293 0.93 HTR2C (0.36) HTR2CHTR2AGAAMAPTHTR2B
SCHEMBL19985303 0.93 HTR2C (0.36) HTR2CHTR2AGAAMAPTHTR2B

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-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
EP-2206695-A1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT Chisso Corporation (JP) 2010-07-14 EP disclosed