SCHEMBL24309403

SCHEMBL24309403

Cn1cc(S(=O)(=O)Nc2nc(Cl)c(C#N)c(Cl)n2)cn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.35
▸ NAMPT P43490 1/20 0.35
▸ PIK3CA P42336 2/20 0.35
▸ NLRP3 Q96P20 1/20 0.35
▸ PIK3CD O00329 2/20 0.35
▸ SCN9A Q15858 2/20 0.34
▸ PTPN11 Q06124 1/20 0.34
▸ EGFR P00533 1/20 0.34
▸ FGFR1 P11362 1/20 0.34
▸ KDR P35968 1/20 0.34
▸ MALT1 Q9UDY8 1/20 0.34
▸ CCNT1 O60563 2/20 0.33
▸ CCNB2 O95067 2/20 0.33
▸ CCNE2 O96020 2/20 0.33
▸ CDK1 P06493 2/20 0.33
▸ CCNB1 P14635 2/20 0.33
▸ CCNE1 P24864 2/20 0.33
▸ CDK2 P24941 2/20 0.33
▸ CDK9 P50750 2/20 0.33
▸ CDK5 Q00535 2/20 0.33

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
SCHEMBL24309813 0.85 NLRP3 (0.38) NAMPTNLRP3PTPN11EGFRFGFR1
SCHEMBL24309387 0.84 PTPN1 (0.37) PTPN1PIK3CDPTPN11MALT1CCNT1
SCHEMBL24309366 0.84 PDE10A (0.38) PIK3CANLRP3PTPN11EGFRFGFR1
SCHEMBL24309731 0.83 HTR1A (0.38) NAMPTNLRP3PTPN11EGFRFGFR1
SCHEMBL24309831 0.83 KAT6A (0.41) NAMPTNLRP3PTPN11EGFRFGFR1
SCHEMBL24310058 0.83 GAA (0.38) NAMPTNLRP3PTPN11EGFRFGFR1
SCHEMBL24309501 0.82 MALT1 (0.37) NAMPTNLRP3PTPN11EGFRFGFR1
SCHEMBL24309573 0.81 HTR1A (0.38) NAMPTNLRP3PTPN11EGFRFGFR1
SCHEMBL24309976 0.80 MALT1 (0.35) NAMPTPIK3CANLRP3PTPN11EGFR
SCHEMBL24309266 0.80 NLRP3 (0.41) NLRP3PTPN11EGFRFGFR1KDR

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 PTPN1 1627/4885NAMPT 1836/4885PIK3CA 667/4885

“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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