SCHEMBL8693265

SCHEMBL8693265

NS(=O)(=O)c1ccccc1-n1ncc(Cl)c1-c1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.52
PTGS1 P23219 9/20 0.52
LMNA P02545 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
CA2 P00918 6/20 0.42
CA1 P00915 5/20 0.42
CA9 Q16790 5/20 0.42
CA12 O43570 4/20 0.42
CA7 P43166 1/20 0.40
TP53 P04637 1/20 0.37
F10 P00742 1/20 0.36
CA4 P22748 1/20 0.35

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
SCHEMBL8639255 0.90 PTGS2 (0.54) PTGS2PTGS1LMNANPSR1CA2
SCHEMBL7059925 0.90 PTGS2 (0.64) PTGS2PTGS1LMNANPSR1CA2
SCHEMBL8689254 0.88 PTGS2 (0.52) PTGS2PTGS1LMNANPSR1CA2
SCHEMBL8637336 0.85 NPSR1 (0.44) PTGS2PTGS1LMNANPSR1CA2
SCHEMBL8692201 0.84 HTT (0.49) PTGS2PTGS1LMNANPSR1CA2
SCHEMBL8638997 0.82 PTGS2 (0.52) PTGS2PTGS1LMNANPSR1CA2
SCHEMBL8688908 0.81 PTGS2 (0.43) PTGS2PTGS1CA2CA1CA9
SCHEMBL8693825 0.80 PTGS2 (0.46) PTGS2PTGS1CA2CA1CA9
SCHEMBL8691904 0.79 PTGS2 (0.49) PTGS2PTGS1CA2CA1CA9
SCHEMBL8688579 0.79 PTGS2 (0.64) PTGS2PTGS1LMNANPSR1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5760068-A NONSTEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G.D. SEARLE & CO. (US) 1998-06-02 US claimed
US-5760068-A NONSTEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G.D. SEARLE & CO. (US) 1998-06-02 US disclosed
US-5756529-A ANTIINFLAMMATORY G.D. SEARLE & CO. (US) 1998-05-26 US disclosed