SCHEMBL6570560

SCHEMBL6570560

Cc1cc(C)c(NS(=O)(=O)c2cccc3ccccc23)cc1NC(=O)Cc1ccc(C#N)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.45
PRSS1 P07477 2/20 0.45
PRSS2 P07478 2/20 0.45
PRSS3 P35030 2/20 0.45
SLC16A3 O15427 3/20 0.43
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
RORC P51449 2/20 0.42
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
LMNA P02545 1/20 0.40
GHSR Q92847 1/20 0.40
IDO1 P14902 1/20 0.40
USP30 Q70CQ3 1/20 0.40
POLB P06746 2/20 0.39
HCRTR1 O43613 1/20 0.39
GALR3 O60755 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL6771137 0.85 F2 (0.62) F2PRSS1PRSS2PRSS3SLC16A3
SCHEMBL6569935 0.84 MCL1 (0.49) RORCLMNAIDO1POLBHTT
SCHEMBL6764618 0.80 RORC (0.47) RORCLMNAIDO1POLBGALR3
SCHEMBL6574029 0.80 RORC (0.40) RORCLMNAIDO1
SCHEMBL6572882 0.75 MEN1 (0.52) HTT
SCHEMBL6574056 0.74 RORC (0.45) RORCLMNAIDO1
SCHEMBL6766786 0.74 F2 (0.60) F2PRSS1PRSS2PRSS3SLC16A3
SCHEMBL6765129 0.73 MGAT2 (0.56) RORCLMNAPOLB
SCHEMBL6762133 0.73 POLB (0.53) RORCLMNAPOLB
SCHEMBL6766536 0.73 HDAC1 (0.52) RORCLMNA

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 3 patents. 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
EP-1414790-A1 SUBSTITUTED N-ACYL ANILINE DERIVATIVES, PRODUCTION AND USE THEREOF AS MEDICAMENTS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2004-05-06 EP disclosed
WO-2003000653-A1 SUBSTITUTED N-ACYL ANILINE DERIVATIVES, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO.KG (DE) 2003-01-03 WO 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 F2 612/4885PRSS1 1283/4885PRSS2 1465/4885

“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.