SCHEMBL862352

SCHEMBL862352

CS(=O)(=O)Nc1ccc(Cl)c(S(=O)(=O)NC(=O)c2c(-c3ccc[nH]c3=O)c3cc(Cl)ccc3n2Cc2ccccc2F)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 1/20 0.41
IDH1 O75874 1/20 0.37
KMT2A Q03164 2/20 0.36
ECE1 P42892 1/20 0.36
FABP5 Q01469 1/20 0.35
AGTR1 P30556 7/20 0.35
AGTR2 P50052 7/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
MAPT P10636 1/20 0.34
POLB P06746 1/20 0.34
FLT1 P17948 1/20 0.34
FLT4 P35916 1/20 0.34
KDR P35968 1/20 0.34
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
SERPINE1 P05121 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
SCHEMBL862747 0.94 CYP2C8 (0.44) CYP2C8IDH1KMT2AECE1AGTR1
SCHEMBL862574 0.90 CYP2C8 (0.41) CYP2C8KMT2AECE1PTGDR2MAPT
SCHEMBL862344 0.88 CYP2C8 (0.43) CYP2C8KMT2AFABP5PTGDR2MAPT
SCHEMBL831554 0.88 CYP2C8 (0.47) CYP2C8KMT2APTGDR2MAPTPOLB
SCHEMBL832758 0.86 CYP2C8 (0.41) CYP2C8KMT2AECE1PTGDR2MAPT
SCHEMBL862454 0.85 CYP2C8 (0.39) CYP2C8KMT2AMAPTFLT1FLT4
SCHEMBL832763 0.84 CYP2C8 (0.42) CYP2C8KMT2APTGDR2MAPTPOLB
SCHEMBL862329 0.84 PPARG (0.40) CYP2C8KMT2AFLT1FLT4KDR
SCHEMBL832426 0.84 CYP2C8 (0.43) CYP2C8IDH1KMT2APTGDR2MAPT
SCHEMBL832380 0.84 CYP2C8 (0.43) CYP2C8IDH1KMT2AECE1PTGDR2

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 CYP2C8 847/4885IDH1 1781/4885KMT2A 321/4885

“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.