SCHEMBL10243151

SCHEMBL10243151

COc1ccc2c(c1)CCn1c-2cc(OCc2ccc(N)c(Oc3cccc(C(F)(F)F)c3)c2)nc1=O

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 19/20 0.56
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PDE4A P27815 2/20 0.46

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
SCHEMBL878017 0.93 GPR84 (0.58) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL883745 0.91 GPR84 (0.57) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL878322 0.91 GPR84 (0.57) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL10243371 0.91 GPR84 (0.61) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL883759 0.90 GPR84 (0.62) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL883524 0.90 GPR84 (0.56) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL10246157 0.90 GPR84 (0.56) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL15092721 0.90 GPR84 (0.56) GPR84KDM4EALDH1A1HPGDMAPK1
SCHEMBL15092914 0.89 GPR84 (0.54) GPR84
SCHEMBL878128 0.87 GPR84 (0.59) 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