SCHEMBL6860698

SCHEMBL6860698

NC(=O)NCc1nc(-c2ccc(F)cc2)c(-c2ccc(S(N)(=O)=O)cc2)o1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.59
PTGS1 P23219 4/20 0.59
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
CA1 P00915 4/20 0.44
CA2 P00918 4/20 0.44
CA12 O43570 3/20 0.44
CA9 Q16790 3/20 0.44
NR4A2 P43354 2/20 0.44
CA4 P22748 1/20 0.43
CA7 P43166 1/20 0.43
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.41

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
SCHEMBL8607283 0.89 PTGS2 (0.57) PTGS2PTGS1MAOAMAOBCA1
SCHEMBL7502827 0.85 NR4A2 (0.62) PTGS2PTGS1MAOAMAOBCA1
SCHEMBL7508637 0.83 PTGS2 (0.67) PTGS2PTGS1MAOAMAOBCA1
SCHEMBL6308685 0.83 PTGS2 (0.60) PTGS2PTGS1MAOAMAOBCA1
SCHEMBL6860700 0.83 PTGS1 (0.41) PTGS2PTGS1CA9NR4A2
SCHEMBL7503465 0.83 PTGS2 (0.62) PTGS2PTGS1MAOAMAOBCA1
SCHEMBL9097538 0.82 NR4A2 (0.56) PTGS2PTGS1CA1CA2CA12
SCHEMBL7506197 0.81 PTGS2 (0.64) PTGS2PTGS1MAOAMAOBCA1
SCHEMBL6308379 0.81 PTGS2 (0.58) PTGS2PTGS1MAOAMAOBCA1
SCHEMBL7505178 0.81 RXRA (0.62) PTGS2PTGS1NR4A2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040248943-A9 Pyrazole substituted hydroxamic acid derivatives as cyclooxygenase-2 and 5-lipoxygenase inhibitors PHARMACIA CORPORATION 2004-12-09 US disclosed
US-20030073722-A1 Pyrazole substituted hydroxamic acid derivatives as cyclooxygenase-2 and 5-lipoxygenase inhibitors PHARMACIA CORPORATION 2003-04-17 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 (2 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-20040248943-A9 Pyrazole substituted hydroxamic acid derivatives as cyclooxygenase-2 and 5-lipoxygenase inhibitors ALOX5, ALOX15, ALOX12 PTGS2 5/4885PTGS1 9/4885MAOA 307/4885
US-20030073722-A1 Pyrazole substituted hydroxamic acid derivatives as cyclooxygenase-2 and 5-lipoxygenase inhibitors ALOX5, ALOX15, ALOX12 PTGS2 5/4885PTGS1 9/4885MAOA 307/4885

“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.