SCHEMBL8767618

SCHEMBL8767618

Fc1ccc(C#Cc2ccc([C@H]3CC[C@H](C4CCCC4)CC3)cc2)cc1F

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.38
EGLN1 Q9GZT9 1/20 0.32
EGLN3 Q9H6Z9 1/20 0.32
P2RY14 Q15391 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
USP30 Q70CQ3 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
SCHEMBL8767510 0.91 GRM5 (0.41) GRM5P2RY14KMT2AUSP30
SCHEMBL8767914 0.88 P2RY14 (0.33) EGLN1EGLN3P2RY14
SCHEMBL8768432 0.88 GRM5 (0.34) GRM5USP30
SCHEMBL8767254 0.87 GRM5 (0.35) GRM5
SCHEMBL10527807 0.83 ESR2 (0.46) GRM5EGLN1EGLN3P2RY14MEN1
SCHEMBL9409313 0.83 CYP2C9 (0.44) GRM5EGLN1EGLN3MEN1KMT2A
SCHEMBL9409308 0.83 CYP2C9 (0.44) GRM5EGLN1EGLN3MEN1KMT2A
SCHEMBL9409316 0.83 CYP2C9 (0.44) GRM5EGLN1EGLN3MEN1KMT2A
SCHEMBL8767567 0.82 HTR2A (0.39) MEN1KMT2AUSP30
SCHEMBL23366152 0.80 HTR2A (0.38) MEN1KMT2AUSP30

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-0789067-A1 Cyclopentyl derivatives useful as liquid crystals Rolic AG (CH) 1997-08-13 EP disclosed