SCHEMBL831417

SCHEMBL831417

CS(=O)(=O)NC(=O)c1c(-c2ccc[nH]c2=O)c2cc(Cl)ccc2n1Cc1ccc(F)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
MEN1 O00255 2/20 0.43
CYP2C8 P10632 1/20 0.42
TP53 P04637 5/20 0.37
SCN9A Q15858 2/20 0.36
CHEK1 O14757 1/20 0.36
CDK1 P06493 1/20 0.36
WEE1 P30291 1/20 0.36
PTGDR2 Q9Y5Y4 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
HPGD P15428 1/20 0.35
MAPT P10636 2/20 0.35

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
SCHEMBL832081 0.94 CYP2C8 (0.44) KMT2AMEN1CYP2C8SCN9APTGDR2
SCHEMBL862750 0.94 CYP2C8 (0.42) KMT2AMEN1CYP2C8SCN9ACHEK1
SCHEMBL831268 0.93 CYP2C8 (0.45) KMT2AMEN1CYP2C8SCN9ACHEK1
SCHEMBL831253 0.91 CYP2C8 (0.45) KMT2AMEN1CYP2C8SCN9APTGDR2
SCHEMBL10257280 0.91 CYP2C8 (0.48) KMT2ACYP2C8SCN9ACHEK1CDK1
SCHEMBL830780 0.91 CYP2C8 (0.44) KMT2AMEN1CYP2C8CHEK1CDK1
SCHEMBL862375 0.90 KMT2A (0.44) KMT2AMEN1CYP2C8PTGDR2KDM4E
SCHEMBL832199 0.90 CYP2C8 (0.46) KMT2ACYP2C8SCN9ACHEK1CDK1
SCHEMBL10257353 0.89 CYP2C8 (0.43) KMT2ACYP2C8SCN9ACHEK1CDK1
SCHEMBL862253 0.89 CYP2C8 (0.45) KMT2ACYP2C8SCN9ACHEK1CDK1

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 KMT2A 321/4885MEN1 2084/4885CYP2C8 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.