SCHEMBL13586568

SCHEMBL13586568

CCCC(O)C1CCC(c2ccc(COC3CCC(c4ccc(C5CO5)c(F)c4F)CC3)c(F)c2F)CC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 1/20 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
SCHEMBL12822552 0.91 GPR119 (0.30) —
SCHEMBL12823007 0.88 KDM4E (0.31) HTR1A
SCHEMBL12823219 0.88 KDM4E (0.31) HTR1A
SCHEMBL12718774 0.88 HTR1A (0.33) HTR1A
SCHEMBL12822087 0.88 ACACB (0.34) HTR1A
SCHEMBL12223474 0.87 HTR1A (0.31) HTR1A
SCHEMBL12719259 0.87 NAAA (0.33) —
SCHEMBL12823356 0.87 NAAA (0.33) —
SCHEMBL12718756 0.85 GPR119 (0.32) —
SCHEMBL12821331 0.85 GPR119 (0.35) HTR1A

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
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 — — WO disclosed
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