SCHEMBL6529191

SCHEMBL6529191

O=C1NCCN1S(=O)(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.56
CYP3A4 P08684 2/20 0.56
CYP2C19 P33261 2/20 0.56
MMP2 P08253 1/20 0.56
CYP2D6 P10635 1/20 0.56
PKM P14618 4/20 0.53
MAPT P10636 2/20 0.49
POLB P06746 2/20 0.47
ALDH1A1 P00352 2/20 0.47
PARL Q9H300 1/20 0.47
HTR6 P50406 5/20 0.46
DRD3 P35462 2/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL11733860 0.89 CYP2C9 (0.53) CYP2C9CYP3A4CYP2C19MMP2CYP2D6
SCHEMBL4005331 0.82 MMP2 (0.59) CYP2C19MMP2PKMMAPTPOLB
SCHEMBL11584726 0.82 MMP2 (0.59) MMP2PKMMAPTPOLBALDH1A1
SCHEMBL5759490 0.80 CYP3A4 (0.64) CYP2C9CYP3A4CYP2C19MMP2CYP2D6
SCHEMBL2989085 0.75 GFER (0.64) CYP2C9CYP3A4CYP2C19MMP2CYP2D6
SCHEMBL6688886 0.73 PKM (0.66) CYP2C9CYP3A4CYP2C19MMP2CYP2D6
SCHEMBL3631733 0.73 KMT2A (0.65) PKMMAPTALDH1A1HTR6
SCHEMBL8972689 0.70 ALDH1A1 (0.69) CYP2C9CYP3A4CYP2C19MMP2CYP2D6
SCHEMBL7380549 0.70 PKM (0.62) CYP2C9CYP3A4CYP2C19MMP2CYP2D6
SCHEMBL14387374 0.70 HTR6 (0.47) CYP2C9CYP3A4CYP2C19CYP2D6PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050032858-A1 Novel heterocyclic compound and anti-inflamatory agent NIPPON SODA CO., LTD. (JP) 2005-02-10 US disclosed
EP-1435353-A1 NOVEL HETEROCYCLIC COMPOUND AND ANTI-INFLAMMATORY AGENT NIPPON SODA CO., LTD. (JP) 2004-07-07 EP disclosed
US-5391757-A Benzenesulfonyl carboxamide compounds intermediate compounds and methods of preparation thereof and use of said compounds and intermediate compounds as herbicidal agents AMERICAN CYANAMID COMPANY (US) 1995-02-21 US disclosed
US-5338883-A Benzenesulfonyl carboxamide compounds intermediate compounds and methods of preparation thereof and use of said compounds and intermediate compounds as herbicidal agents AMERICAN CYANAMID COMPANY (US) 1994-08-16 US disclosed
US-5252539-A Benzenesulfonyl carboxamide compounds intermediate compounds and method of preparation thereof and use of said compounds and intermediate compounds as herbicidal agents AMERICAN CYANAMID COMPANY (US) 1993-10-12 US disclosed
US-5120854-A Benzenesulfonyl carboxamide compounds and intermediate compounds AMERICAN CYANAMID COMPANY (US) 1992-06-09 US disclosed
US-4992094-A Herbicides AMERICAN CYANAMID COMPANY (US) 1991-02-12 US disclosed
US-4883914-A Benzenesulfonyl carboxamide compounds useful as herbicidal agents AMERICAN CYANAMID COMPANY (US) 1989-11-28 US disclosed
US-4107304-A Oxo-imidazolidine substituted cephalosporins and antibacterial compositions and methods of combatting bacteria employing them BAYER AKTIENGESELLSCHAFT (DE) 1978-08-15 US disclosed
US-4093722-A ANTIBIOTICS BAYER AKTIENGESELLSCHAFT (DT) 1978-06-06 US disclosed
US-4086340-A ANTIBIOTIC; ANIMAL GROWTH PROMOTER BAYER AKTIENGESELLSCHAFT (DT) 1978-04-25 US disclosed
US-4009272-A ANTIBIOTIC BAYER AKTIENGESELLSCHAFT (DT) 1977-02-22 US disclosed
US-3983105-A Penicillins BAYER AKTIENGESELLSCHAFT (DT) 1976-09-28 US disclosed
US-3978056-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-31 US disclosed
US-3975375-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-17 US disclosed
US-3974142-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-10 US disclosed
US-3974141-A IMIDAZOLIDINYL-CARBAMIDOBACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-10 US disclosed
US-3972869-A Penicillins BAYER AKTIENGESELLSCHAFT (DT) 1976-08-03 US disclosed
US-3972870-A IMIDAZOLIDINYL-CARBAMIDO-BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-03 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 (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-20050032858-A1 Novel heterocyclic compound and anti-inflamatory agent TLR5, IRF3, IL4 CYP2C9 3393/4885CYP3A4 1019/4885CYP2C19 2934/4885

“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.