SCHEMBL6764616

SCHEMBL6764616

Cc1ccc(NS(=O)(=O)c2ccccc2C(F)(F)F)cc1NC(=O)Cc1ccc(C(=N)N)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 8/20 0.44
F2 P00734 7/20 0.44
PRSS1 P07477 6/20 0.44
PRSS2 P07478 6/20 0.44
PRSS3 P35030 6/20 0.44
HIF1A Q16665 1/20 0.43
PKLR P30613 1/20 0.42
MRGPRX1 Q96LB2 1/20 0.41
RORC P51449 1/20 0.40

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
SCHEMBL6766786 0.86 F2 (0.60) F2PRSS1PRSS2PRSS3
SCHEMBL6765424 0.84 F2 (0.55) F2PRSS1PRSS2PRSS3
SCHEMBL6764538 0.83 F2 (0.43) F2PRSS1PRSS2PRSS3HIF1A
SCHEMBL6767804 0.81 SMN1; SMN2 (0.54) F2PRSS1PRSS2PRSS3
SCHEMBL6765892 0.80 ALDH1A1 (0.50) F2PRSS1PRSS2PRSS3
SCHEMBL6765244 0.80 FFAR4 (0.50) F2PRSS1PRSS2PRSS3RORC
SCHEMBL6762119 0.79 TMPRSS6 (0.57) F2PRSS1PRSS2PRSS3
SCHEMBL6762034 0.78 F2 (0.41) F2PRSS1PRSS2PRSS3
SCHEMBL6771025 0.77 F2 (0.55) F2PRSS1PRSS2PRSS3
SCHEMBL6771137 0.75 F2 (0.62) F2PRSS1PRSS2PRSS3

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 SLC22A12 852/4885F2 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.