SCHEMBL21577530

SCHEMBL21577530

Fc1cc(C#Cc2ccc(C3CCC(C4CC4)CC3)cc2)cc(F)c1N=C=S

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 1/20 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
SCHEMBL21577536 0.96 P2RY14 (0.31) P2RY14
SCHEMBL21577531 0.96 P2RY14 (0.31) P2RY14
SCHEMBL24390777 0.91 P2RY14 (0.30) P2RY14
SCHEMBL23511121 0.91 P2RY14 (0.30) P2RY14
SCHEMBL21577535 0.90 HDAC2 (0.33) P2RY14
SCHEMBL21577526 0.90 ESR2 (0.42) P2RY14
SCHEMBL25919448 0.89 CYP3A4 (0.34) P2RY14
SCHEMBL21577534 0.88 ESR2 (0.33) P2RY14
SCHEMBL21577529 0.88 ESR2 (0.38) P2RY14
SCHEMBL22666488 0.87 P2RY14 (0.31) P2RY14

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11306251-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2022-04-19 US disclosed
WO-2022008474-A1 OPTICAL COMPONENT MERCK PATENT GMBH (DE) 2022-01-13 WO disclosed
US-20190352564-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2019-11-21 US disclosed