SCHEMBL6513353

SCHEMBL6513353

CC(=O)c1ccc(-c2cscn2)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 1/20 0.42
KDM4B O94953 1/20 0.42
KDM5C P41229 1/20 0.42
KDM5B Q9UGL1 1/20 0.42
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CHEK2 O96017 1/20 0.40
EIF4E P06730 3/20 0.39
MAPT P10636 2/20 0.39
CREBBP Q92793 1/20 0.39
HSD17B1 P14061 1/20 0.38
SYK P43405 1/20 0.36
S100A4 P26447 1/20 0.36
ADRB2 P07550 1/20 0.36
METAP1 P53582 1/20 0.36
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL6313985 0.84 KDM4A (0.43) KDM4AKDM4BKDM5CKDM5BNPC1
SCHEMBL6313842 0.82 SYK (0.43) KDM4AKDM4BKDM5CKDM5BNPC1
SCHEMBL6516157 0.81 ADORA2A (0.43) KDM4AKDM4BKDM5CKDM5BNPC1
SCHEMBL6513294 0.80 ECE1 (0.45) KDM4AKDM4BKDM5CKDM5BNPC1
SCHEMBL27599990 0.79 CHEK2 (0.46) KDM4AKDM4BKDM5CKDM5BNPC1
SCHEMBL6524808 0.77 PLOD2 (0.43) KDM4AKDM4BKDM5CKDM5BNPC1
SCHEMBL9911398 0.76 METAP1 (0.47) NPC1RAB9AEIF4EMAPTMETAP1
SCHEMBL6516547 0.74 DHODH (0.40) KDM4AKDM4BKDM5CKDM5BNPC1
SCHEMBL6512655 0.74 CHEK2 (0.49) KDM4AKDM4BKDM5CKDM5BSMN1; SMN2
SCHEMBL7855714 0.74 KAT6A (0.54) KDM4AKDM4BKDM5CKDM5BNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6949536-B2 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents PFIZER, INC. (US) 2005-09-27 US disclosed
US-20040157824-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents PFIZER INC. 2004-08-12 US disclosed
EP-1086097-B1 SULFONYLBENZENE COMPOUNDS AS ANTI-INFLAMMATORY/ANALGESIC AGENTS PFIZER (US) 2004-05-19 EP disclosed
US-6727238-B2 CYCLOOXYGENASE INHIBITORS PFIZER INC. 2004-04-27 US disclosed
US-20030225064-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents ANDO KAZUO (JP) 2003-12-04 US disclosed
US-6608095-B2 Sulfonylbenzene and sulfonamidobenzene compounds which inhibit COX-2; treatment of a medical condition in which prostaglandins are implicated as pathogens PFIZER INC. 2003-08-19 US disclosed
US-20020045654-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents ANDO KAZUO (JP) 2002-04-18 US disclosed
US-6294558-B1 ANTIINFLAMMATORY AGENTS AND PROSTAGLANTINS PFIZER INC. 2001-09-25 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 (3 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-20040157824-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents CNR1, PTGS1, PTGER1 KDM4A 1875/4885KDM4B 2068/4885KDM5C 1564/4885
US-20020045654-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents CNR1, PTGER1, PTGS1 KDM4A 1609/4885KDM4B 1699/4885KDM5C 1603/4885
US-20030225064-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents CNR1, PTGS1, PTGER1 KDM4A 1875/4885KDM4B 2068/4885KDM5C 1564/4885

“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.