SCHEMBL6729437

SCHEMBL6729437

Cc1nc(C2=C(c3ccc(CS(=O)(=O)Cc4ccc(C5=C(c6csc(C)n6)CCC5)cc4F)c(F)c3)CCC2)cs1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HSD17B10 Q99714 1/20 0.40
ALDH1A1 P00352 6/20 0.39
RAB9A P51151 5/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HTT P42858 2/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
NPC1 O15118 4/20 0.39
PTGS1 P23219 2/20 0.38
HPGD P15428 2/20 0.38
MAPT P10636 2/20 0.36
MMP12 P39900 1/20 0.36
GFER P55789 1/20 0.35
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
RECQL P46063 1/20 0.35
ESR2 Q92731 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
SCHEMBL6722937 0.82 PTGS2 (0.40) PTGS2PTGS1
SCHEMBL7048741 0.82 PTGS2 (0.47) PTGS2SMN1; SMN2HSD17B10ALDH1A1RAB9A
SCHEMBL6721399 0.81 PTGS2 (0.46) PTGS2SMN1; SMN2HSD17B10ALDH1A1RAB9A
SCHEMBL6721832 0.81 PTGS2 (0.41) PTGS2PTGS1
SCHEMBL6722092 0.80 PTGS2 (0.48) PTGS2PTGS1
SCHEMBL6722877 0.80 PTGS2 (0.51) PTGS2PTGS1
SCHEMBL6718366 0.78 PTGS2 (0.50) PTGS2PTGS1
SCHEMBL6718983 0.78 PTGS2 (0.47) PTGS2PTGS1
SCHEMBL6721801 0.78 PTGS2 (0.47) PTGS2PTGS1
SCHEMBL6718738 0.78 PTGS2 (0.58) 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 1 patent. 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

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-20040092552-A1 2-Fluorobenzenesulfonyl compounds for the treatment of inflammation FPR2, PTGES2, FPR1 PTGS2 5/4885SMN1; SMN2 1990/4885HSD17B10 1231/4885

“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.