SCHEMBL6342129

SCHEMBL6342129

COc1ccccc1C(=O)Nc1ccc2ccc3c(C(N)=O)nn(-c4ccc(S(N)(=O)=O)cc4)c3c2c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.55
CA1 P00915 7/20 0.48
CA2 P00918 7/20 0.48
CA9 Q16790 4/20 0.48
POLB P06746 3/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
CA4 P22748 2/20 0.47
CA7 P43166 2/20 0.47
THRB P10828 2/20 0.46
CA12 O43570 2/20 0.46
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 2/20 0.44
RXFP1 Q9HBX9 1/20 0.43

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
SCHEMBL6626661 0.90 PTGS2 (0.46) PTGS2CA1CA2CA9CA4
SCHEMBL6342809 0.89 PTGS2 (0.49) PTGS2CA1CA2CA9CA4
SCHEMBL6343697 0.87 PTGS2 (0.46) PTGS2CA1CA2CA9KMT2A
SCHEMBL6340626 0.87 KMT2A (0.55) PTGS2CA1CA2CA9POLB
SCHEMBL6354562 0.85 PTGS2 (0.46) PTGS2CA1CA2CA9CA4
SCHEMBL6343380 0.84 PTGS2 (0.49) PTGS2CA1CA2CA9POLB
SCHEMBL6350930 0.84 KMT2A (0.46) PTGS2CA1CA2CA9POLB
SCHEMBL6342695 0.83 IKBKB (0.51) PTGS2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6342102 0.83 CA2 (0.48) PTGS2CA1CA2CA9CA4
SCHEMBL6353442 0.82 CRACR2A (0.43) PTGS2KMT2AMAPTSMN1; SMN2ALDH1A1

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-20030125361-A1 Substituted pyrazolyl benzenesulfamide compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-07-03 US claimed
US-6849653-B2 1H-benzo(g)indazole compounds as anticarcinogenic agents and also treat arthritis PHARMACIA CORPORATION (US) 2005-02-01 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-20030125361-A1 Substituted pyrazolyl benzenesulfamide compounds for the treatment of inflammation IRAK4, NLRP3, CXCL8 PTGS2 37/4885CA1 3893/4885CA2 4013/4885

“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.