SCHEMBL24309813

SCHEMBL24309813

Cn1cc(S(=O)(=O)Nc2nc(Cl)c(Cl)c(Cl)n2)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ EGFR P00533 2/20 0.37
▸ FGFR1 P11362 2/20 0.37
▸ KDR P35968 2/20 0.37
▸ PTPN11 Q06124 1/20 0.37
▸ HIF1A Q16665 1/20 0.36
▸ MALT1 Q9UDY8 1/20 0.36
▸ CCNT1 O60563 2/20 0.36
▸ CCNB2 O95067 2/20 0.36
▸ CCNE2 O96020 2/20 0.36
▸ CDK1 P06493 2/20 0.36
▸ CCNB1 P14635 2/20 0.36
▸ CCNE1 P24864 2/20 0.36
▸ CDK2 P24941 2/20 0.36
▸ CDK9 P50750 2/20 0.36
▸ CDK5 Q00535 2/20 0.36

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
SCHEMBL24309366 0.90 PDE10A (0.38) NLRP3SMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL24309831 0.89 KAT6A (0.41) NLRP3SMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL24310058 0.89 GAA (0.38) NLRP3SMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL24309501 0.87 MALT1 (0.37) NLRP3SMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL24309573 0.86 HTR1A (0.38) NLRP3SMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL24309731 0.86 HTR1A (0.38) NLRP3SMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL24309266 0.85 NLRP3 (0.41) NLRP3SMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL24310190 0.85 MALT1 (0.36) NLRP3SMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL24309403 0.85 PTPN1 (0.35) NLRP3SMN1; SMN2ALDH1A1HTTL3MBTL1
SCHEMBL24309413 0.85 KAT6A (0.35) NLRP3SMN1; SMN2ALDH1A1HTTL3MBTL1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230373935-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS, SAN DIEGO 2023-11-23 — — US disclosed
US-20230373935-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS, SAN DIEGO 2023-11-23 — — US disclosed
EP-4225748-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR Vertex Pharmaceuticals Incorporated (US) 2023-08-16 — — EP disclosed
WO-2022076627-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-04-14 — — WO disclosed
WO-2022076627-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-04-14 — — 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 (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-20230373935-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1G, SCNN1B NLRP3 2084/4885SMN1; SMN2 4847/4885ALDH1A1 3992/4885

“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.

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