SCHEMBL10266643

SCHEMBL10266643

CCc1ccc2c(c1)c(-c1cc(Cl)c[nH]c1=O)c(C(=O)NS(=O)(=O)C1CC1)n2Cc1ccccc1F

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
MAPT P10636 2/20 0.35
EDNRB P24530 1/20 0.35
AURKA O14965 1/20 0.34
TPX2 Q9ULW0 1/20 0.34
PARG Q86W56 2/20 0.34
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP2C8 P10632 1/20 0.34
SCN9A Q15858 6/20 0.33
TRPM4 Q8TD43 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
SCN5A Q14524 3/20 0.32
SCN4A P35499 1/20 0.32

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
SCHEMBL862295 0.93 HDAC1 (0.34) EDNRBAURKATPX2TP53SCN9A
SCHEMBL13905325 0.91 AURKA (0.37) KMT2AMEN1MAPTAURKATPX2
SCHEMBL8858779 0.91 KMT2A (0.40) KMT2AMEN1MAPTAURKATPX2
SCHEMBL831751 0.89 CYP2C8 (0.41) KMT2AMEN1MAPTEDNRBAURKA
SCHEMBL831963 0.86 CYP2C8 (0.40) KMT2AMEN1MAPTEDNRBPARG
SCHEMBL831787 0.86 CYP2C8 (0.40) KMT2AMEN1MAPTEDNRBPARG
SCHEMBL832157 0.85 KMT2A (0.38) KMT2AMEN1MAPTEDNRBPARG
SCHEMBL10255645 0.84 KCNH2 (0.34) AURKATPX2SCN9ATRPM4SCN5A
SCHEMBL8858776 0.84 SCN9A (0.40) KMT2AMEN1MAPTEDNRBSCN9A
SCHEMBL831683 0.83 CYP2C8 (0.38) KMT2AMEN1EDNRBAURKATPX2

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 KMT2A 321/4885MEN1 2084/4885MAPT 1047/4885

“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.