SCHEMBL13586156

SCHEMBL13586156

CCOc1ccc(/C=C/C2CCC(c3ccc(C4CCC(C(C)O)CC4)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 5/20 0.33

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
SCHEMBL13586099 1.00 ACACB (0.33) ACACB
SCHEMBL12718230 0.91 HTR2C (0.33) ACACB
SCHEMBL12716495 0.91 KDM1A (0.38) —
SCHEMBL1242657 0.90 KDM1A (0.32) —
SCHEMBL1242653 0.90 KDM1A (0.32) —
SCHEMBL10302861 0.90 ACACB (0.31) ACACB
SCHEMBL13586100 0.89 — —
SCHEMBL12718228 0.89 — —
SCHEMBL12823664 0.88 ACACB (0.31) ACACB
SCHEMBL12823201 0.88 ACACB (0.31) ACACB

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
Send feedback