SCHEMBL6721399

SCHEMBL6721399

Cc1nc(C2=C(c3ccc(S(N)(=O)=O)c(F)c3)CCC2)cs1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 12/20 0.46
PTGS1 P23219 9/20 0.46
ALDH1A1 P00352 4/20 0.42
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
PTGES2 Q9H7Z7 1/20 0.41
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HPGD P15428 2/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
RECQL P46063 1/20 0.39
ESR2 Q92731 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL7048741 0.90 PTGS2 (0.47) PTGS2PTGS1ALDH1A1RAB9ANPC1
SCHEMBL6728407 0.85 PTGS2 (0.43) PTGS2PTGS1ALDH1A1RAB9ANPC1
SCHEMBL6739511 0.83 PTGES2 (0.37) PTGS2ALDH1A1RAB9ANPC1PTGES2
SCHEMBL6726438 0.82 PTGS2 (0.46) PTGS2PTGS1LMNA
SCHEMBL6729437 0.81 PTGS2 (0.40) PTGS2PTGS1ALDH1A1RAB9ANPC1
SCHEMBL6728874 0.81 PTGS2 (0.47) PTGS2PTGS1
SCHEMBL6721681 0.80 PTGS2 (0.43) PTGS2PTGS1ALDH1A1RAB9ANPC1
SCHEMBL6718370 0.79 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL6726711 0.79 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL6725781 0.78 PTGS2 (0.55) PTGS2PTGS1

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 4 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
EP-1296971-A2 2-FLUOROBENZENESULFONYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION Pharmacia Corporation (US) 2003-04-02 EP disclosed
US-20020183362-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2002-12-05 US disclosed
WO-2001081332-A2 2-FLUOROBENZENESULFONYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION PHARMACIA CORPORATION (US) 2001-11-01 WO 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 4/4885ALDH1A1 263/4885
US-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885PTGS1 4/4885ALDH1A1 298/4885

“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.