SCHEMBL7458329

SCHEMBL7458329

CS(=O)(=O)c1ccc(-c2ccc(Cc3ccc(-c4ccccc4)cc3)[nH]2)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 11/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
HSD17B10 Q99714 1/20 0.46
PTGS1 P23219 3/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CNR1 P21554 1/20 0.42
SCD O00767 1/20 0.41
RORC P51449 2/20 0.41
NR1I2 O75469 1/20 0.41
RORA P35398 1/20 0.41
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41
RORB Q92753 1/20 0.41
NR1H4 Q96RI1 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
SCHEMBL4491047 0.78 CYP1A2 (0.53) CYP1A2CYP2C9HSD17B10NR1H2NR1H3
SCHEMBL1687503 0.74 PTGS2 (0.79) PTGS2PTGS1CA12CA1CA2
SCHEMBL8770202 0.74 PTGS2 (0.79) PTGS2PTGS1CA12CA1CA2
SCHEMBL27768226 0.74 PTGS2 (0.44) PTGS2PTGS1
SCHEMBL16770523 0.73 CA12 (0.58) PTGS2PTGS1CA12CA1CA2
SCHEMBL17283680 0.72 PTGS2 (0.50) PTGS2PTGS1CA12CA2CA9
SCHEMBL22015857 0.71 PTGS2 (0.58) PTGS2HSD17B10RORCNR1I2RORA
SCHEMBL13477842 0.70 CCNC (0.35) PTGS2CYP2C9HSD17B10PTGS1
SCHEMBL13231429 0.69 ENPP2 (0.54) PTGS2CA12CA1CA2CA9
SCHEMBL8646859 0.68 PTGS2 (0.68) PTGS2PTGS1CA12CA1CA2

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-20020045654-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents ANDO KAZUO (JP) 2002-04-18 US claimed

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-20020045654-A1 Sulfonylbenzene compounds as anti-inflammatory/analgesic agents CNR1, PTGER1, PTGS1 PTGS2 30/4885CYP1A2 923/4885CYP2C9 1021/4885

“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.