SCHEMBL862725

SCHEMBL862725

COc1ccc(S(=O)(=O)NC(=O)c2c(-c3ccc[nH]c3=O)c3cc(Cl)ccc3n2Cc2ccc3c(c2)NCC3)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.43
FLT1 P17948 2/20 0.39
FLT4 P35916 2/20 0.39
KDR P35968 2/20 0.39
ADAM17 P78536 1/20 0.37
MCL1 Q07820 3/20 0.37
BCL2 P10415 1/20 0.36
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
SERPINE1 P05121 1/20 0.35
FBP1 P09467 1/20 0.35
CCR2 P41597 1/20 0.34
PTPN1 P18031 1/20 0.34
AKR1C3 P42330 1/20 0.34
AKR1C2 P52895 1/20 0.34

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
SCHEMBL862656 0.88 KMT2A (0.37) PPARGMCL1CCR2
SCHEMBL862043 0.88 PPARG (0.35) PPARGMCL1SERPINE1
SCHEMBL831806 0.85 PPARG (0.45) PPARGFLT1FLT4KDRADAM17
SCHEMBL862434 0.83 PPARG (0.48) PPARGMCL1CCR2
SCHEMBL12674109 0.82 CYP2C8 (0.43) PPARGSERPINE1CCR2
SCHEMBL862131 0.82 PPARG (0.47) PPARGFLT1FLT4KDRFBP1
SCHEMBL12665219 0.78 MAPK8 (0.45) CCR2
SCHEMBL862179 0.78 PPARG (0.48) PPARGMCL1CCR2
SCHEMBL862465 0.78 PPARG (0.40) PPARGMCL1BCL2SERPINE1
SCHEMBL832261 0.78 FLT1 (0.41) PPARGFLT1FLT4KDRMCL1

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-8143305-B2 2,3-substituted indole derivatives for treating viral infections SCHERING CORPORATION (US) 2012-03-27 US disclosed
US-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS MERCK SHARP & DOHME CORP. 2011-02-10 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 (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-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS IDO2, IDO1, IRF3 PPARG 4093/4885FLT1 3635/4885FLT4 2781/4885

“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.