SCHEMBL2224740

SCHEMBL2224740

CN(CCO)S(=O)(=O)c1cccc(Br)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.52
KDM4E B2RXH2 2/20 0.52
MEN1 O00255 2/20 0.52
ALDH1A1 P00352 2/20 0.52
RXFP1 Q9HBX9 1/20 0.52
GBA1 P04062 1/20 0.43
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
ATM Q13315 1/20 0.41
TLR8 Q9NR97 1/20 0.41
IKBKB O14920 1/20 0.40
CHUK O15111 1/20 0.40
AURKB Q96GD4 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
SCHEMBL14938228 0.86 TAAR1 (0.47) KMT2AKDM4EALDH1A1RXFP1GBA1
SCHEMBL31454298 0.86 GBA1 (0.44) KMT2AMEN1ALDH1A1GBA1HDAC3
SCHEMBL938569 0.84 SMN1; SMN2 (0.51) KMT2AMEN1ALDH1A1ATMGAA
SCHEMBL17479365 0.82 GBA1 (0.44) KMT2AMEN1ALDH1A1RXFP1GBA1
SCHEMBL15276793 0.82 SIRT2 (0.54) KMT2AMEN1ALDH1A1MAPTNPC1
SCHEMBL2852904 0.81 KMT2A (0.56) KMT2AKDM4EMEN1ALDH1A1RXFP1
SCHEMBL2414975 0.80 SIGMAR1 (0.57) KMT2AKDM4EMEN1ALDH1A1RXFP1
SCHEMBL5722103 0.80 KMT2A (0.53) KMT2AKDM4EMEN1ALDH1A1RXFP1
SCHEMBL29811921 0.79 PGR (0.52) KMT2AKDM4EMEN1ALDH1A1RXFP1
SCHEMBL16143059 0.78 GBA1 (0.52) KMT2AKDM4EALDH1A1GBA1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107148417-B Benzazepine sulfonamide compounds 豪夫迈·罗氏有限公司 2020-09-08 CN disclosed
EP-3233835-B1 BENZAZEPINE SULFONAMIDE COMPOUNDS HOFFMANN LA ROCHE (CH) 2019-01-23 EP disclosed
EP-3233835-B1 BENZAZEPINE SULFONAMIDE COMPOUNDS HOFFMANN LA ROCHE (CH) 2019-01-23 EP disclosed
US-9890124-B2 Benzazepine sulfonamide compounds HOFFMANN-LA ROCHE INC. (US) 2018-02-13 US disclosed
US-9890124-B2 Benzazepine sulfonamide compounds HOFFMANN-LA ROCHE INC. (US) 2018-02-13 US disclosed
US-9890124-B2 Benzazepine sulfonamide compounds HOFFMANN-LA ROCHE INC. (US) 2018-02-13 US disclosed
EP-3233835-A1 BENZAZEPINE SULFONAMIDE COMPOUNDS F. Hoffmann-La Roche AG (CH) 2017-10-25 EP disclosed
US-20170275253-A1 BENZAZEPINE SULFONAMIDE COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2017-09-28 US disclosed
US-20170275253-A1 BENZAZEPINE SULFONAMIDE COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2017-09-28 US disclosed
US-20170275253-A1 BENZAZEPINE SULFONAMIDE COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2017-09-28 US disclosed
WO-2016096778-A1 BENZAZEPINE SULFONAMIDE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2016-06-23 WO disclosed
EP-2523952-B1 OXAZOLE KINASE INHIBITORS AB SCIENCE (FR) 2015-03-04 EP disclosed
US-8962665-B2 Thiazole and oxazole kinase inhibitors AB SCIENCE (FR) 2015-02-24 US disclosed
US-20130035331-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS AB SCIENCE (FR) 2013-02-07 US disclosed
EP-2523952-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS AB Science (FR) 2012-11-21 EP disclosed
WO-2011086085-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS AB SCIENCE (FR) 2011-07-21 WO disclosed
WO-2010100144-A1 FUSED BICYCLIC COMPOUNDS AS INHIBITORS FOR PI3 KINASE MERCK SERONO S.A. (CH) 2010-09-10 WO disclosed
WO-2010100144-A1 FUSED BICYCLIC COMPOUNDS AS INHIBITORS FOR PI3 KINASE MERCK SERONO S.A. (CH) 2010-09-10 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 (2 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-20170275253-A1 BENZAZEPINE SULFONAMIDE COMPOUNDS TLR8, TLR7, TLR5 KMT2A 752/4885KDM4E 1601/4885MEN1 3548/4885
US-20130035331-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS SYK, LTK, MERTK KMT2A 1415/4885KDM4E 873/4885MEN1 3607/4885

“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.