SCHEMBL6767041

SCHEMBL6767041

Cc1cc(NS(=O)(=O)c2ccccc2)cc(C)c1NC(=O)Cc1ccc(C(=N)N)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TMPRSS6 Q8IU80 2/20 0.53
F2 P00734 9/20 0.52
PRSS1 P07477 2/20 0.52
PRSS2 P07478 1/20 0.52
PRSS3 P35030 1/20 0.52
HDAC1 Q13547 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
CYTH2 Q99418 1/20 0.48
MCL1 Q07820 1/20 0.46
PLAU P00749 1/20 0.46
HPN P05981 1/20 0.46
LMNA P02545 1/20 0.45
ITGB3 P05106 1/20 0.45
ITGA2B P08514 1/20 0.45
F10 P00742 1/20 0.44

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
SCHEMBL6765337 0.89 F2 (0.52) TMPRSS6F2PRSS1PRSS2PRSS3
SCHEMBL6771025 0.88 F2 (0.55) TMPRSS6F2PRSS1PRSS2PRSS3
SCHEMBL6766137 0.88 TMPRSS6 (0.53) TMPRSS6F2PRSS1PRSS2PRSS3
SCHEMBL6765424 0.86 F2 (0.55) TMPRSS6F2PRSS1PRSS2PRSS3
SCHEMBL6764627 0.84 F2 (0.60) TMPRSS6F2PRSS1PRSS2PRSS3
SCHEMBL6764877 0.83 F2 (0.57) TMPRSS6F2PRSS1PRSS2PRSS3
SCHEMBL6574016 0.82 HDAC1 (0.51) HDAC1HDAC8CYTH2MCL1LMNA
SCHEMBL6762119 0.82 TMPRSS6 (0.57) TMPRSS6F2PRSS1PRSS2PRSS3
SCHEMBL6765941 0.81 F2 (0.59) TMPRSS6F2PRSS1PRSS2PRSS3
SCHEMBL6771080 0.81 F2 (0.51) TMPRSS6F2PRSS1PRSS2PRSS3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040248897-A1 Substituted N-acylaniline derivatives, the preparation thereof, and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-12-09 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-20040248897-A1 Substituted N-acylaniline derivatives, the preparation thereof, and their use as pharmaceutical compositions NAT1, CYP3A5, CYP3A7 TMPRSS6 4040/4885F2 612/4885PRSS1 1283/4885

“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.