SCHEMBL5198301

SCHEMBL5198301

CS(=O)(=O)c1ccc(-c2cc(-c3c[nH]nc3-c3cccc(C4CC4)n3)ccc2F)cc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.42
PTGS1 P23219 1/20 0.42
GABRA2 P47869 2/20 0.41
FAAH O00519 1/20 0.38
TGFBR1 P36897 6/20 0.38
MAPK14 Q16539 5/20 0.38
KDR P35968 4/20 0.38
RIPK2 O43353 1/20 0.37
PRKDC P78527 1/20 0.37
SCD O00767 1/20 0.36
FADS1 O60427 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
SCHEMBL5198229 0.90 PTGS2 (0.39) PTGS2PTGS1GABRA2FAAHTGFBR1
SCHEMBL5199341 0.86 TGFBR1 (0.44) PTGS2TGFBR1MAPK14KDRRIPK2
SCHEMBL5198372 0.77 PTGS2 (0.45) PTGS2PTGS1GABRA2TGFBR1
SCHEMBL5199026 0.76 TGFBR1 (0.42) PTGS2PTGS1GABRA2FAAHTGFBR1
SCHEMBL5199436 0.76 GABRA2 (0.42) GABRA2TGFBR1MAPK14KDR
SCHEMBL5199938 0.76 TGFBR1 (0.41) TGFBR1MAPK14KDRRIPK2
SCHEMBL5199610 0.76 TGFBR1 (0.42) PTGS2GABRA2TGFBR1MAPK14KDR
SCHEMBL5199630 0.76 TGFBR1 (0.42) PTGS2GABRA2TGFBR1MAPK14KDR
SCHEMBL5199855 0.74 TGFBR1 (0.45) GABRA2TGFBR1MAPK14KDRRIPK2
SCHEMBL5199678 0.74 MAP2K4 (0.42) TGFBR1

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 PTGS2 2062/4885PTGS1 1855/4885GABRA2 472/4885

“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.