SCHEMBL9757092

SCHEMBL9757092

C(=Cc1ccc2ccccc2n1)c1cccc(OCc2cccc3oc(-c4nnn[nH]4)nc23)c1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 8/20 0.45
CYSLTR1 Q9Y271 8/20 0.45
GLA P06280 1/20 0.37
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
PKM P14618 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL9757170 0.91 CYSLTR1 (0.46) CYSLTR2CYSLTR1
SCHEMBL9757288 0.86 CYSLTR2 (0.46) CYSLTR2CYSLTR1
SCHEMBL9757139 0.85 CYSLTR1 (0.50) CYSLTR2CYSLTR1
SCHEMBL9757159 0.81 CYSLTR1 (0.49) CYSLTR2CYSLTR1
SCHEMBL9757084 0.80 CYSLTR1 (0.38) CYSLTR2CYSLTR1
SCHEMBL9757235 0.79 CYSLTR2 (0.49) CYSLTR2CYSLTR1
SCHEMBL9757276 0.79 CYSLTR2 (0.49) CYSLTR2CYSLTR1
SCHEMBL9756983 0.79 CYSLTR2 (0.49) CYSLTR2CYSLTR1
SCHEMBL9757167 0.77 CYSLTR1 (0.47) CYSLTR2CYSLTR1
SCHEMBL9757140 0.77 CYSLTR1 (0.47) CYSLTR2CYSLTR1

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