SCHEMBL6722945

SCHEMBL6722945

CS(=O)(=O)c1ccc(-c2c(-c3cccc(Cl)c3)noc2CO)cc1F

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.45
PTGS1 P23219 2/20 0.42
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 2/20 0.36
PKM P14618 1/20 0.36
TRPV1 Q8NER1 7/20 0.36
BRD4 O60885 1/20 0.36
ATM Q13315 1/20 0.35
GPBAR1 Q8TDU6 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
SCHEMBL6729941 0.92 PTGS2 (0.43) PTGS2PTGS1BRD4
SCHEMBL6721984 0.91 PTGS2 (0.46) PTGS2PTGS1RAB9AKMT2AALDH1A1
SCHEMBL6722694 0.90 PTGS2 (0.53) PTGS2PTGS1RAB9AALDH1A1PKM
SCHEMBL6730378 0.90 PTGS2 (0.47) PTGS2PTGS1ALDH1A1BRD4
SCHEMBL6721472 0.89 PTGS2 (0.46) PTGS2PTGS1ALDH1A1BRD4
SCHEMBL6729979 0.89 PTGS2 (0.45) PTGS2PTGS1ALDH1A1BRD4
SCHEMBL6725376 0.89 PTGS2 (0.46) PTGS2PTGS1RAB9AALDH1A1TRPV1
SCHEMBL6733277 0.88 PTGS2 (0.58) PTGS2PTGS1ALDH1A1BRD4
SCHEMBL6729164 0.88 PTGS2 (0.45) PTGS2PTGS1KMT2AALDH1A1BRD4
SCHEMBL6732666 0.88 PTGS2 (0.44) PTGS2PTGS1RAB9AKMT2AALDH1A1

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-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-05-13 US disclosed
US-20020183362-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2002-12-05 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-20020183362-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, FPR1, PTGES2 PTGS2 5/4885PTGS1 4/4885RAB9A 3587/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885PTGS1 4/4885RAB9A 3650/4885

“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.