SCHEMBL883757

SCHEMBL883757

Cc1ccc2c(c1)CCn1c-2cc(OCc2ccc(Oc3cccc(C(F)(F)F)n3)c(N)c2)nc1=O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 18/20 0.47
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
MAPK1 P28482 2/20 0.45
HSD17B10 Q99714 1/20 0.45
PDE4A P27815 3/20 0.43
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL883547 0.92 GPR84 (0.49) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL15093084 0.89 GPR84 (0.48) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL877192 0.84 GPR84 (0.49) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL883498 0.83 GPR84 (0.61) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL878380 0.82 GPR84 (0.59) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL883781 0.81 GPR84 (0.47) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL878257 0.81 GPR84 (0.54) GPR84
SCHEMBL883500 0.80 GPR84 (0.48) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL877809 0.80 GPR84 (0.51) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL883504 0.79 GPR84 (0.50) GPR84KDM4EALDH1A1HPGDMAPK1

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-2012037782-A1 TRICYCLIC COMPOUNDS, PREPARATION METHODS, AND THEIR USES GLAXO GROUP LIMITED (GB) 2012-03-29 WO disclosed