SCHEMBL10375581

SCHEMBL10375581

CCCCCOC1=C(C(=O)Nc2ccccn2)N(C)S(=O)(=O)c2ccccc21

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 4/20 0.67
KDM4E B2RXH2 3/20 0.67
USP2 O75604 3/20 0.67
CYP2C9 P11712 2/20 0.67
PTGS2 P35354 2/20 0.67
CYP1A2 P05177 1/20 0.67
CYP3A4 P08684 1/20 0.67
CYP2D6 P10635 1/20 0.67
ALOX15 P16050 1/20 0.67
NFKB1 P19838 1/20 0.67
CYP2C19 P33261 1/20 0.67
BLM P54132 1/20 0.67
SLC22A6 Q4U2R8 1/20 0.67
SLC22A8 Q8TCC7 1/20 0.67
MAPK1 P28482 1/20 0.66
LMNA P02545 2/20 0.65
HTR2B P41595 1/20 0.65
HTR1A P08908 1/20 0.62
GAA P10253 1/20 0.52
POLB P06746 3/20 0.50

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
SCHEMBL11224348 0.99 PTGS1 (0.66) PTGS1KDM4EUSP2CYP2C9PTGS2
SCHEMBL11038084 0.99 PTGS1 (0.66) PTGS1KDM4EUSP2CYP2C9PTGS2
SCHEMBL10539753 0.94 LMNA (0.63) PTGS1KDM4EUSP2CYP2C9PTGS2
SCHEMBL9646931 0.93 LMNA (0.62) PTGS1KDM4EUSP2CYP2C9PTGS2
SCHEMBL10540821 0.91 PTGS1 (0.66) PTGS1KDM4EUSP2CYP2C9PTGS2
SCHEMBL10544146 0.91 PTGS1 (0.69) PTGS1KDM4EUSP2CYP2C9PTGS2
SCHEMBL9645016 0.90 PTGS1 (0.70) PTGS1KDM4EUSP2CYP2C9PTGS2
SCHEMBL10964467 0.90 PTGS1 (0.70) PTGS1KDM4EUSP2CYP2C9PTGS2
SCHEMBL10543471 0.90 LMNA (0.72) PTGS1KDM4EUSP2CYP2C9PTGS2
SCHEMBL11221145 0.89 PTGS1 (0.64) PTGS1KDM4EUSP2CYP2C9PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0208404-B1 BENZOTHIAZINE DIOXIDE DERIVATIVES PFIZER INC. (US) 1990-08-29 EP disclosed
EP-0208404-A2 Benzothiazine dioxide derivatives PFIZER INC. (US) 1987-01-14 EP disclosed
US-4623486-A [4-substituted benzoyloxy]-N-substituted-2H-1,2-benzothiazine-3-carboxamide 1,1-dioxides having anti-arthritic activity PFIZER INC. (US) 1986-11-18 US disclosed
EP-0057059-B1 BENZOTHIAZINE DIOXIDE ANTI-INFLAMMATORY AGENTS, PROCESSES FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PFIZER INC. (US) 1984-03-07 EP disclosed
EP-0057059-A1 Benzothiazine dioxide anti-inflammatory agents, processes for their preparation, and pharmaceutical compositions containing them PFIZER INC. (US) 1982-08-04 EP disclosed
US-4309427-A ANTIINFLAMMATORY AGENTS PFIZER INC. (US) 1982-01-05 US disclosed