SCHEMBL14922644

SCHEMBL14922644

CCCCOc1ccc(-c2ccc(CCC3CCC(C4CCC(c5ccc(OCCCC)c(F)c5F)CC4)CC3)c(F)c2F)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
SCN9A Q15858 1/20 0.32

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
SCHEMBL14922525 0.98 CTSL (0.33) CTSLCTSSCTSKSCN9A
SCHEMBL15381557 0.97 CTSL (0.35) CTSLCTSSCTSKSCN9A
SCHEMBL15381626 0.97 CTSL (0.35) CTSLCTSSCTSKSCN9A
SCHEMBL12196728 0.95 CTSL (0.31) CTSLCTSSCTSK
SCHEMBL15381750 0.95 CTSL (0.34) CTSLCTSSCTSKSCN9A
SCHEMBL15381673 0.95 CTSL (0.34) CTSLCTSSCTSKSCN9A
SCHEMBL424497 0.94 SCN9A (0.32) SCN9A
SCHEMBL14922506 0.93 CTSL (0.33) CTSLCTSSCTSK
SCHEMBL14922511 0.93 SCN9A (0.35) SCN9A
SCHEMBL11933281 0.92 CTSL (0.33) CTSLCTSSCTSKSCN9A

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-8435422-B2 Five-ring compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-05-07 US disclosed