SCHEMBL8775009

SCHEMBL8775009

CCCc1ccc([C@H]2CC[C@H](c3cc(F)c(F)nc3F)CC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 13/20 0.42
SPHK2 Q9NRA0 7/20 0.37

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
SCHEMBL8775016 1.00 SPHK1 (0.42) SPHK1SPHK2
SCHEMBL8774873 0.92 SPHK1 (0.49) SPHK1SPHK2
SCHEMBL8774869 0.92 SPHK1 (0.49) SPHK1SPHK2
SCHEMBL8774490 0.91 SPHK1 (0.54) SPHK1SPHK2
SCHEMBL8774483 0.91 SPHK1 (0.54) SPHK1SPHK2
SCHEMBL8774560 0.89 SPHK1 (0.35) SPHK1SPHK2
SCHEMBL8774570 0.89 SPHK1 (0.35) SPHK1SPHK2
SCHEMBL8774565 0.88 SPHK1 (0.39) SPHK1SPHK2
SCHEMBL8774574 0.88 SPHK1 (0.39) SPHK1SPHK2
SCHEMBL8774794 0.86 PANK3 (0.36)

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
EP-0519370-B1 Heterocyclic derivatives MERCK PATENT GMBH (DE) 1997-11-05 EP disclosed
EP-0519370-A2 Heterocyclic derivatives MERCK PATENT GmbH (DE) 1992-12-23 EP disclosed