SCHEMBL5670855

SCHEMBL5670855

Cc1ccc(N2C(=O)CSC2c2ccc(S(C)(=O)=O)cc2)cc1F

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 6/20 0.73
PTGS1 P23219 2/20 0.71
GFER P55789 2/20 0.62
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2C19 P33261 1/20 0.62
CA1 P00915 5/20 0.57
CA2 P00918 5/20 0.57
CA9 Q16790 5/20 0.57
HTR7 P34969 7/20 0.53
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL27540392 0.85 PTGS2 (0.67) PTGS2PTGS1GFERCYP1A2CYP3A4
SCHEMBL5672007 0.84 PTGS2 (0.81) PTGS2PTGS1GFERCA1CA2
SCHEMBL5670285 0.84 PTGS2 (1.00) PTGS2PTGS1GFERCA1CA2
SCHEMBL19306221 0.82 HTR7 (0.80) PTGS2PTGS1HTR7
SCHEMBL5670856 0.80 PTGS2 (0.79) PTGS2PTGS1GFERCA1CA2
SCHEMBL5671915 0.79 PTGS2 (1.00) PTGS2PTGS1GFERCA1CA2
SCHEMBL5672162 0.77 PTGS2 (0.74) PTGS2PTGS1GFERCA1CA2
SCHEMBL19306049 0.73 HTR7 (0.75) HTR7
SCHEMBL28627439 0.73 PTGS2 (0.58) PTGS2PTGS1CA1CA2CA9
SCHEMBL19306453 0.72 HTR7 (0.63) PTGS2GFERCA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506180-A4 THIAZOLIDINE-4-ONE DERIVATIVE, METHOD FOR PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME CJ CORP (KR) 2006-04-05 EP claimed
EP-1506180-A1 THIAZOLIDINE-4-ONE DERIVATIVE, METHOD FOR PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME CJ Corporation (KR) 2005-02-16 EP claimed
US-6777434-B2 CYCLOOXYGENASE INHIBITOR, ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS CJ CORP. (KR) 2004-08-17 US claimed
WO-2003097620-A1 THIAZOLIDINE-4-ONE DERIVATIVE, METHOD FOR PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME CJ CORPORATION (KR) 2003-11-27 WO claimed
US-20030216454-A1 Thiazolidine-4-one derivative, method for preparing the same, and pharmaceutical composition containing the same CJ CHEILJEDANG CORPORATION (KR) 2003-11-20 US claimed
EP-1506180-A4 THIAZOLIDINE-4-ONE DERIVATIVE, METHOD FOR PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME CJ CORP (KR) 2006-04-05 EP disclosed
EP-1506180-A1 THIAZOLIDINE-4-ONE DERIVATIVE, METHOD FOR PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME CJ Corporation (KR) 2005-02-16 EP disclosed
US-6777434-B2 CYCLOOXYGENASE INHIBITOR, ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS CJ CORP. (KR) 2004-08-17 US disclosed
WO-2003097620-A1 THIAZOLIDINE-4-ONE DERIVATIVE, METHOD FOR PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME CJ CORPORATION (KR) 2003-11-27 WO disclosed
US-20030216454-A1 Thiazolidine-4-one derivative, method for preparing the same, and pharmaceutical composition containing the same CJ CHEILJEDANG CORPORATION (KR) 2003-11-20 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-20030216454-A1 Thiazolidine-4-one derivative, method for preparing the same, and pharmaceutical composition containing the same SLC5A1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, NAT1 PTGS2 3143/4885PTGS1 1150/4885GFER 4354/4885

“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.