SCHEMBL5227673

SCHEMBL5227673

Cc1cccc(-c2nc(C(C)C)[nH]c2-c2cccc(-c3ccc(C(N)=O)nc3)c2)n1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.50
TLR7 Q9NYK1 2/20 0.50
TGFBR1 P36897 13/20 0.42
KDM4E B2RXH2 1/20 0.39
TGFBR2 P37173 2/20 0.38
KDR P35968 2/20 0.38
MAPK14 Q16539 2/20 0.38
RIPK2 O43353 1/20 0.38
ACVR1B P36896 1/20 0.38
PDGFRA P16234 1/20 0.37
FLT1 P17948 1/20 0.37
FLT4 P35916 1/20 0.37
PRKD1 Q15139 1/20 0.37
IRAK4 Q9NWZ3 1/20 0.37
GRM5 P41594 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 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
SCHEMBL5226169 0.87 TGFBR1 (0.46) TGFBR1KDM4EKDRMAPK14RIPK2
SCHEMBL5199910 0.82 RXRA (0.46) TGFBR1KDM4EMAPK14GRM5
SCHEMBL5197863 0.79 CA2 (0.46) TGFBR1KDM4E
SCHEMBL5226188 0.78 TGFBR1 (0.52) TGFBR1KDM4EKDRMAPK14RIPK2
SCHEMBL5198533 0.76 PFKFB3 (0.43) TGFBR1KDM4EMAPK14IRAK4
SCHEMBL5198037 0.76 TGFBR1 (0.51) TGFBR1KDM4EKDRMAPK14RIPK2
SCHEMBL5230665 0.76 TGFBR1 (0.49) TLR8TLR7TGFBR1KDM4EGRM5
SCHEMBL5199410 0.75 POLB (0.47) TLR8TLR7TGFBR1GRM5
SCHEMBL5199960 0.74 TGFBR1 (0.42) TLR8TLR7TGFBR1KDM4EGRM5
SCHEMBL5200756 0.74 TGFBR1 (0.49) TGFBR1KDRFLT1FLT4

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
US-20070275968-A1 Substituted Biphenyl Derivative SANKYO COMPANY, LIMITED (JP) 2007-11-29 US disclosed
EP-1798229-A1 SUBSTITUTED BIPHENYL DERIVATIVE Sankyo Company, Limited (JP) 2007-06-20 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070275968-A1 Substituted Biphenyl Derivative COL2A1, COL1A1, FGFR3 TLR8 2599/4885TLR7 867/4885TGFBR1 40/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.