SCHEMBL6192129

SCHEMBL6192129

CC(=O)Nc1ccc(S(N)(=O)=O)c(C)c1

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.73
CA2 P00918 8/20 0.57
CA1 P00915 6/20 0.57
CA9 Q16790 5/20 0.57
CA12 O43570 4/20 0.57
CA7 P43166 2/20 0.53
LMNA P02545 1/20 0.52
MAPT P10636 2/20 0.52
TP53 P04637 1/20 0.52
CDK1 P06493 1/20 0.51
PKM P14618 2/20 0.50
PTGES2 Q9H7Z7 1/20 0.49
IDO1 P14902 1/20 0.48
POLB P06746 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL22843944 0.88 ALDH1A1 (0.61) ALDH1A1CA2CA1CA9CA12
SCHEMBL2318661 0.85 ALDH1A1 (1.00) ALDH1A1CA2CA1CA9CA12
SCHEMBL14502114 0.85 ALDH1A1 (0.76) ALDH1A1CA2CA1CA9CA12
SCHEMBL2314592 0.84 ALDH1A1 (0.69) ALDH1A1CA2CA1CA9CA12
SCHEMBL539699 0.83 ALDH1A1 (0.73) ALDH1A1CA2CA1CA9CA12
SCHEMBL1522635 0.83 CA2 (0.57) ALDH1A1CA2CA1CA9CA12
Hydrochloric Acid SCHEMBL7531560 0.83 ALDH1A1 (0.73) ALDH1A1CA2CA1CA9CA12
SCHEMBL24809088 0.82 ALDH1A1 (0.71) ALDH1A1LMNAMAPTTP53CDK1
SCHEMBL29740181 0.82 ALDH1A1 (0.50) ALDH1A1CA2CA1CA9CA12
SCHEMBL6391196 0.82 CA2 (0.56) ALDH1A1CA2CA1CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1594866-A1 ANTIPROLIFERATIVE 2-(SULFO-PHENYL)-AMINOTHIAZOLE DERIVATIVES PFIZER INC. (US) 2005-11-16 EP disclosed
US-6949536-B2 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents PFIZER, INC. (US) 2005-09-27 US disclosed
US-20040176431-A1 Antiproliferative 2-(sulfo-phenyl)-aminothiazole derivatives and pharmaceutical compositions, and methods for their use PFIZER, INC. 2004-09-09 US disclosed
WO-2004072070-A1 ANTIPROLIFERATIVE 2-(SULFO-PHENYL)-AMINOTHIAZOLE DERIVATIVES PFIZER INC. (US) 2004-08-26 WO 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
EP-1086097-A1 SULFONYLBENZENE COMPOUNDS AS ANTI-INFLAMMATORY/ANALGESIC AGENTS PFIZER INC. (US) 2001-03-28 EP disclosed
WO-1999064415-A1 SULFONYLBENZENE COMPOUNDS AS ANTI-INFLAMMATORY/ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 1999-12-16 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 (4 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 ALDH1A1 593/4885CA2 459/4885CA1 1790/4885
US-20020045654-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents CNR1, PTGER1, PTGS1 ALDH1A1 599/4885CA2 523/4885CA1 2083/4885
US-20030225064-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents CNR1, PTGS1, PTGER1 ALDH1A1 593/4885CA2 459/4885CA1 1790/4885
US-20040176431-A1 Antiproliferative 2-(sulfo-phenyl)-aminothiazole derivatives and pharmaceutical compositions, and methods for their use MKI67, TK1, CDK2 ALDH1A1 849/4885CA2 2313/4885CA1 3833/4885

“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.