SCHEMBL962598

SCHEMBL962598

Cc1nn(C)c(-n2ccc3cc(Cl)ccc32)c1C=CC(=O)NS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGER3 P43115 5/20 0.41
FLT1 P17948 7/20 0.40
FLT4 P35916 7/20 0.40
KDR P35968 7/20 0.40
MAPT P10636 1/20 0.40
NR2F2 P24468 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PHGDH O43175 3/20 0.38
EGFR P00533 1/20 0.38
PTGFR P43088 2/20 0.36
PTGER1 P34995 1/20 0.36
PTGER4 P35408 1/20 0.36
PTGER2 P43116 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
SCHEMBL962596 1.00 PTGER3 (0.41) PTGER3FLT1FLT4KDRMAPT
SCHEMBL963421 0.96 FLT1 (0.41) PTGER3FLT1FLT4KDRMAPT
SCHEMBL963423 0.96 FLT1 (0.41) PTGER3FLT1FLT4KDRMAPT
SCHEMBL965316 0.95 PTGER3 (0.40) PTGER3FLT1FLT4KDRMAPT
SCHEMBL965317 0.95 PTGER3 (0.40) PTGER3FLT1FLT4KDRMAPT
SCHEMBL962857 0.93 FLT1 (0.43) PTGER3FLT1FLT4KDRMAPT
SCHEMBL962859 0.93 FLT1 (0.43) PTGER3FLT1FLT4KDRMAPT
SCHEMBL965338 0.93 FLT1 (0.40) PTGER3FLT1FLT4KDRMAPT
SCHEMBL965340 0.93 FLT1 (0.40) PTGER3FLT1FLT4KDRMAPT
SCHEMBL964366 0.92 PTGER3 (0.44) PTGER3FLT1FLT4KDRMAPT

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-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-13 US disclosed
US-20080194617-A1 Fused ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-14 US 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 (2 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-20080194617-A1 Fused ring compound SLC5A1, SLC5A2, GPR119 PTGER3 2949/4885FLT1 1862/4885FLT4 2164/4885
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA PPARA, PPARD, PPARG PTGER3 456/4885FLT1 1015/4885FLT4 915/4885

“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.