SCHEMBL8399177

SCHEMBL8399177

CCCCC[Si@H]1CC[C@H]([C@H]2CC[C@H](c3ccc(F)cc3)CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 13/20 0.40
SPHK2 Q9NRA0 7/20 0.35
HTR7 P34969 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
SCHEMBL8040071 1.00 SPHK1 (0.40) SPHK1SPHK2HTR7
SCHEMBL8399171 1.00 SPHK1 (0.40) SPHK1SPHK2HTR7
SCHEMBL8040074 1.00 SPHK1 (0.40) SPHK1SPHK2HTR7
SCHEMBL7756522 0.91 SPHK1 (0.40) SPHK1SPHK2HTR7
SCHEMBL7756526 0.91 SPHK1 (0.40) SPHK1SPHK2HTR7
SCHEMBL8025909 0.90 SPHK1 (0.42) SPHK1SPHK2
SCHEMBL7755786 0.90 SPHK1 (0.42) SPHK1SPHK2
SCHEMBL8084474 0.90 SPHK1 (0.42) SPHK1SPHK2
SCHEMBL8084470 0.90 SPHK1 (0.42) SPHK1SPHK2
SCHEMBL7755790 0.90 SPHK1 (0.42) SPHK1SPHK2

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-5951913-A Liquid crystal compositions comprising silacyclohexane compounds SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-09-14 US disclosed
EP-0630903-B1 A silacyclohexane compound, a method of preparing it and a liquid crystal composition containing it SHINETSU CHEMICAL CO (JP) 1999-06-02 EP disclosed