SCHEMBL862443

SCHEMBL862443

CCn1c(C(=O)NS(=O)(=O)c2cccc(NS(C)(=O)=O)c2)c(-c2ccc[nH]c2=O)c2cc(Cl)ccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 1/20 0.36
PTGER4 P35408 1/20 0.36
FLT1 P17948 7/20 0.36
FLT4 P35916 7/20 0.36
KDR P35968 7/20 0.36
PPARG P37231 3/20 0.36
RORC P51449 1/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
CYP1A2 P05177 2/20 0.34
HPGD P15428 2/20 0.34
KMT2A Q03164 2/20 0.34
HTT P42858 2/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
CYP2C19 P33261 1/20 0.34
RECQL P46063 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP2C8 P10632 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.33

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
SCHEMBL862296 0.92 PPARG (0.41) TDP2PPARGKMT2AMEN1CYP2C8
SCHEMBL10257021 0.91 PPARG (0.39) TDP2FLT1FLT4KDRPPARG
SCHEMBL862476 0.91 PPARG (0.36) TDP2FLT1FLT4KDRPPARG
SCHEMBL862329 0.91 PPARG (0.40) TDP2FLT1FLT4KDRPPARG
SCHEMBL862454 0.90 CYP2C8 (0.39) TDP2FLT1FLT4KDRPPARG
SCHEMBL862488 0.90 SERPINE1 (0.38) TDP2FLT1FLT4KDRPPARG
SCHEMBL862708 0.90 CYP2C8 (0.38) TDP2FLT1FLT4KDRPPARG
SCHEMBL832354 0.90 PPARG (0.38) TDP2FLT1FLT4KDRPPARG
SCHEMBL862422 0.90 ALDH1A1 (0.39) TDP2FLT1FLT4KDRPPARG
SCHEMBL862192 0.89 PPARG (0.39) TDP2PPARGKMT2AMEN1CYP2C8

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 TDP2 971/4885PTGER4 2953/4885FLT1 3635/4885

“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.