SCHEMBL4749786

SCHEMBL4749786

NC(=O)Cc1ccccc1S(N)(=O)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 13/20 0.49
CA2 P00918 13/20 0.49
CA9 Q16790 8/20 0.49
CA12 O43570 4/20 0.45
CA6 P23280 3/20 0.45
CA5A P35218 3/20 0.45
CA4 P22748 2/20 0.45
CA7 P43166 2/20 0.45
CA5B Q9Y2D0 2/20 0.45
CYP2C9 P11712 1/20 0.45
CA14 Q9ULX7 1/20 0.45
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP3 P08254 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MMP12 P39900 1/20 0.42
MMP13 P45452 1/20 0.42
MMP14 P50281 1/20 0.42
MMP16 P51512 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
SCHEMBL18281576 0.85 TTR (0.43) CA1CA2CA9MMP1MMP2
SCHEMBL10362231 0.85 AKR1B1 (0.59) CA1CA2CA9CA12CA6
SCHEMBL2655044 0.83 MEN1 (0.43) CA1CA2CA9MMP1MMP2
SCHEMBL20565283 0.83 MMP2 (0.41) CA1CA2CA9MMP1MMP2
Hydrochloric Acid SCHEMBL6647677 0.81 MEN1 (0.43) CA1CA2MMP1MMP2MMP3
SCHEMBL28247232 0.81 MMP2 (0.41) CA1CA2CYP2C9MMP1MMP2
SCHEMBL6026669 0.80 CA1 (0.54) CA1CA2CA9CA12CA6
SCHEMBL18322483 0.80 CA1 (0.45) CA1CA2CA9CA12CA6
SCHEMBL11324205 0.79 PTGDR2 (0.45) MMP1MMP2MMP3MMP9MMP8
SCHEMBL10364238 0.79 CA1 (0.54) CA1CA2CA9CA12CA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3307715-A1 AROMATIC SULFONAMIDE DERIVATIVES Bayer Pharma Aktiengesellschaft (DE) 2018-04-18 EP claimed
WO-2016198374-A1 AROMATIC SULFONAMIDE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-12-15 WO claimed
CN-110407730-A Pyrrolidones herbicide FMC CORP 2019-11-05 CN disclosed
CN-106414403-B Pyrrolidinone herbicides FMC公司 2019-08-30 CN disclosed
CN-106232594-B Substituted 2-pyrimidinyl oxy benzene compound herbicide FMC公司 2019-08-23 CN disclosed
US-20180338980-A1 AROMATIC SULFONAMIDE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-11-29 US disclosed
CN-106659159-A Herbicidal triazoles 杜邦公司 2017-05-10 CN disclosed
CN-106414403-A Pyrrolidinone herbicides 纳幕尔杜邦公司 2017-02-15 CN disclosed
WO-2008140251-A2 CYCLOOXYGENASE-2 INHIBITORS UNIVERSITY-INDUSTRY COOPERATION GROUP OF KYUNG HEE UNIVERSITY (KR) 2008-11-20 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-20180338980-A1 AROMATIC SULFONAMIDE DERIVATIVES ARSA, SULT2A1, TPST2 CA1 3821/4885CA2 2486/4885CA9 918/4885

“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.