SCHEMBL831409

SCHEMBL831409

CS(=O)(=O)NC(=O)c1c(-c2ccc[nH]c2=O)c2cc(Cl)c(Cl)cc2n1Cc1ccnc(N)c1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 1/20 0.40
CCR2 P41597 1/20 0.38
MCL1 Q07820 1/20 0.37
PPARG P37231 1/20 0.35
KMT2A Q03164 7/20 0.34
RCE1 Q9Y256 1/20 0.34
MEN1 O00255 2/20 0.33
F11 P03951 2/20 0.33
PTPRG P23470 1/20 0.33
RHEB Q15382 1/20 0.32
SCN9A Q15858 2/20 0.31

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
SCHEMBL831545 0.92 KMT2A (0.40) CYP2C8CCR2MCL1PPARGKMT2A
SCHEMBL832603 0.90 CYP2C8 (0.40) CYP2C8MCL1KMT2ARCE1MEN1
SCHEMBL10260727 0.88 PPARG (0.38) CYP2C8CCR2MCL1PPARGKMT2A
SCHEMBL862469 0.88 PPARG (0.36) CYP2C8MCL1PPARGKMT2AMEN1
SCHEMBL862475 0.88 PPARG (0.36) CYP2C8CCR2MCL1PPARGKMT2A
SCHEMBL10257730 0.87 PPARG (0.35) CYP2C8CCR2MCL1PPARGKMT2A
SCHEMBL12665251 0.87 CYP2C8 (0.49) CYP2C8CCR2KMT2ARCE1MEN1
SCHEMBL861876 0.86 PPARG (0.35) CYP2C8MCL1PPARGKMT2AMEN1
SCHEMBL862413 0.85 PPARG (0.43) CYP2C8MCL1PPARGKMT2AMEN1
SCHEMBL831718 0.85 KMT2A (0.40) CYP2C8MCL1KMT2ARCE1MEN1

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 CYP2C8 847/4885CCR2 106/4885MCL1 872/4885

“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.