SCHEMBL832400

SCHEMBL832400

CCc1ccc2c(c1)c(-c1ccc[nH]c1=O)c(C(=O)NS(=O)(=O)C1CC1)n2Cc1cc(S(=O)(=O)NC(C)(C)C)ccc1F

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 1/20 0.35
PARG Q86W56 4/20 0.33
TP53 P04637 2/20 0.32
PPARG P37231 3/20 0.32
MAPT P10636 1/20 0.32
BRD4 O60885 1/20 0.31
SCN9A Q15858 2/20 0.31
SCN5A Q14524 1/20 0.31
AURKA O14965 1/20 0.30
TPX2 Q9ULW0 1/20 0.30
GNRHR P30968 1/20 0.30
MMP10 P09238 1/20 0.30
MMP13 P45452 1/20 0.30
LMNA P02545 1/20 0.30
USP30 Q70CQ3 1/20 0.30
SERPINE1 P05121 1/20 0.30

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
SCHEMBL832311 0.92 CYP2C8 (0.37) CYP2C8PARGBRD4SCN9ASCN5A
SCHEMBL831639 0.91 CYP2C8 (0.37) CYP2C8PARGTP53PPARGSCN9A
SCHEMBL831325 0.91 CYP2C8 (0.37) CYP2C8PARGTP53PPARGMAPT
SCHEMBL831683 0.89 CYP2C8 (0.38) CYP2C8PPARGSCN9ASCN5AAURKA
SCHEMBL12665438 0.88 CYP2C8 (0.45) CYP2C8PARGBRD4GNRHRMMP10
SCHEMBL832356 0.88 CYP2C8 (0.40) CYP2C8SCN9ASCN5AAURKATPX2
SCHEMBL831551 0.88 SCN9A (0.40) CYP2C8PARGPPARGSCN9ASCN5A
SCHEMBL831751 0.88 CYP2C8 (0.41) CYP2C8PARGTP53MAPTSCN9A
SCHEMBL832072 0.87 CYP2C8 (0.36) CYP2C8PARGPPARGSCN9ASCN5A
SCHEMBL862746 0.87 AGTR1 (0.35) CYP2C8TP53MAPTSCN9ASCN5A

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 847/4885PARG 3471/4885TP53 789/4885

“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.