SCHEMBL9757084

SCHEMBL9757084

C=C(c1cccc(OCc2cccc3oc(-c4nnn[nH]4)nc23)c1)c1ccc2ccccc2n1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 4/20 0.38
GPBAR1 Q8TDU6 1/20 0.38
CYSLTR2 Q9NS75 2/20 0.35
CNR2 P34972 1/20 0.34

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
SCHEMBL9757164 0.91 NR4A2 (0.33) CYSLTR1CYSLTR2
SCHEMBL9757283 0.86 CYSLTR1 (0.38) CYSLTR1GPBAR1CYSLTR2CNR2
SCHEMBL9757139 0.84 CYSLTR1 (0.50) CYSLTR1GPBAR1CYSLTR2
SCHEMBL9757159 0.80 CYSLTR1 (0.49) CYSLTR1CYSLTR2
SCHEMBL9757092 0.80 CYSLTR2 (0.45) CYSLTR1CYSLTR2
SCHEMBL9757221 0.79 CYSLTR1 (0.49) CYSLTR1GPBAR1CYSLTR2
SCHEMBL9757264 0.79 CYSLTR1 (0.49) CYSLTR1GPBAR1CYSLTR2
SCHEMBL9756982 0.78 FFAR1 (0.39) CYSLTR1
SCHEMBL9757132 0.78 FFAR1 (0.43)
SCHEMBL9756999 0.78 MAPT (0.35) CYSLTR1GPBAR1CYSLTR2

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
WO-1991019475-A2 QUINOLINYL-BENZOHETEROBICYCLIC DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D¿4? RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1991-12-26 WO disclosed