SCHEMBL10798690

SCHEMBL10798690

CCCc1c(O)[c]ccc1OCc1ccc(Cc2nnn[nH]2)cc1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 10/20 0.39
CYSLTR2 Q9NS75 5/20 0.39
GRM2 Q14416 6/20 0.33
CTSD P07339 5/20 0.32
GPR84 Q9NQS5 1/20 0.31

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
SCHEMBL10799377 0.92 CYSLTR1 (0.39) CYSLTR1CYSLTR2GRM2CTSDGPR84
SCHEMBL10974390 0.90 CYSLTR1 (0.35) CYSLTR1CYSLTR2GRM2CTSD
SCHEMBL10798437 0.90 CYSLTR1 (0.38) CYSLTR1CYSLTR2GRM2CTSDGPR84
SCHEMBL10799118 0.85 CYSLTR2 (0.38) CYSLTR1CYSLTR2
SCHEMBL10798791 0.82 CYSLTR1 (0.36) CYSLTR1CYSLTR2GRM2CTSDGPR84
SCHEMBL10656630 0.81 CYSLTR2 (0.40) CYSLTR1CYSLTR2GRM2
SCHEMBL10750458 0.81 CYSLTR2 (0.39) CYSLTR1CYSLTR2GRM2
SCHEMBL10798804 0.80 CYSLTR1 (0.35) CYSLTR1CYSLTR2GRM2GPR84
SCHEMBL10726976 0.78 CYSLTR1 (0.64) CYSLTR1CYSLTR2GRM2CTSD
SCHEMBL10799322 0.76 MEN1 (0.36) CYSLTR1CYSLTR2GRM2CTSDGPR84

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-0132124-B1 NOVEL PHARMACEUTICAL COMPOUNDS AND THEIR PREPARATION Lilly Industries Limited (GB) 1987-09-23 EP disclosed
EP-0132124-A1 Novel pharmaceutical compounds and their preparation Lilly Industries Limited (GB) 1985-01-23 EP disclosed