SCHEMBL6571948

SCHEMBL6571948

Cc1cc(NS(=O)(=O)c2ccccc2)cc(NC(=O)Cc2ccc(C#N)cc2)c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
RORC P51449 3/20 0.48
MCL1 Q07820 1/20 0.47
CYTH2 Q99418 1/20 0.46
KDM1A O60341 1/20 0.45
LMNA P02545 1/20 0.45
IDO1 P14902 1/20 0.44
AR P10275 1/20 0.43
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
PKM P14618 1/20 0.42
ALOX15 P16050 1/20 0.42
HTT P42858 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
BRD4 O60885 1/20 0.42
ATIC P31939 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL6766536 0.89 HDAC1 (0.52) HDAC1HDAC8RORCMCL1KDM1A
SCHEMBL6762133 0.89 POLB (0.53) HDAC1HDAC8RORCMCL1KDM1A
SCHEMBL6574016 0.89 HDAC1 (0.51) HDAC1HDAC8RORCMCL1CYTH2
SCHEMBL6767177 0.85 HDAC1 (0.51) HDAC1HDAC8RORCMCL1KDM1A
SCHEMBL6569935 0.85 MCL1 (0.49) HDAC1HDAC8RORCMCL1KDM1A
SCHEMBL6570647 0.84 MCL1 (0.54) HDAC1HDAC8RORCMCL1KDM1A
SCHEMBL6766083 0.84 HDAC1 (0.51) HDAC1HDAC8RORCMCL1KDM1A
SCHEMBL6765337 0.83 F2 (0.52) HDAC1HDAC8MCL1CYTH2POLB
SCHEMBL6765129 0.83 MGAT2 (0.56) HDAC1HDAC8RORCKDM1ALMNA
SCHEMBL6764580 0.83 HDAC1 (0.45) HDAC1HDAC8RORCMCL1KDM1A

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 HDAC1 696/4885HDAC8 723/4885RORC 1596/4885

“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.