SCHEMBL830979

SCHEMBL830979

CS(=O)(=O)NC(=O)c1c(-c2ccc[nH]c2=O)c2cc(Cl)ccc2n1Cc1ccc(OC(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.41
KMT2A Q03164 3/20 0.39
CYP2C8 P10632 1/20 0.38
MCL1 Q07820 2/20 0.38
SCN9A Q15858 2/20 0.37
MAPK8 P45983 2/20 0.36
P2RX3 P56373 3/20 0.34
CCR2 P41597 1/20 0.34
PER2 O15055 1/20 0.34
PTGDR2 Q9Y5Y4 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
SCHEMBL862434 0.91 PPARG (0.48) PPARGKMT2ACYP2C8MCL1MAPK8
SCHEMBL862037 0.90 KMT2A (0.44) PPARGKMT2ACYP2C8MCL1MAPK8
SCHEMBL862795 0.90 PPARG (0.49) PPARGKMT2ACYP2C8SCN9APTGDR2
SCHEMBL862439 0.90 PPARG (0.45) PPARGKMT2ACYP2C8MCL1SCN9A
SCHEMBL862375 0.90 KMT2A (0.44) PPARGKMT2ACYP2C8MCL1MAPK8
SCHEMBL862465 0.89 PPARG (0.40) PPARGKMT2ACYP2C8MCL1MAPK8
SCHEMBL862622 0.88 CYP2C8 (0.42) PPARGKMT2ACYP2C8MCL1MAPK8
SCHEMBL862357 0.88 KMT2A (0.44) PPARGKMT2ACYP2C8MCL1MAPK8
SCHEMBL862156 0.88 KMT2A (0.42) PPARGKMT2ACYP2C8MCL1MAPK8
SCHEMBL862067 0.88 KMT2A (0.50) PPARGKMT2ACYP2C8MCL1MAPK8

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 4 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-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
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 4093/4885KMT2A 321/4885CYP2C8 847/4885

“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.