SCHEMBL20113158

SCHEMBL20113158

Cc1ccc(CC(C)CF)c(F)c1F

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.34
HTT P42858 1/20 0.31
CTSS P25774 1/20 0.30
CTSK P43235 1/20 0.30

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
SCHEMBL13003913 0.85 P2RX7 (0.31) P2RX7CTSSCTSK
SCHEMBL23366807 0.84
SCHEMBL6126230 0.82 CTSS (0.41) P2RX7HTTCTSSCTSK
SCHEMBL489837 0.74 P2RX7 (0.36) P2RX7HTT
SCHEMBL27073675 0.72 P2RX7 (0.36) P2RX7HTT
SCHEMBL19887751 0.72 P2RX7 (0.40) P2RX7HTT
SCHEMBL19887771 0.72 P2RX7 (0.40) P2RX7HTT
SCHEMBL8190076 0.70 P2RX7 (0.39) P2RX7HTT
SCHEMBL24776452 0.69 P2RX7 (0.42) P2RX7HTT
SCHEMBL1434378 0.69 P2RX7 (0.35) P2RX7HTT

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
EP-2753675-B1 LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2018-05-02 EP disclosed