SCHEMBL24309239

SCHEMBL24309239

Cc1cccc(C)c1-c1cc(Cl)nc(NS(=O)(=O)c2cnn(C)c2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 3/20 0.40
▸ CCNB2 O95067 3/20 0.40
▸ CCNE2 O96020 3/20 0.40
▸ CDK1 P06493 3/20 0.40
▸ CCNB1 P14635 3/20 0.40
▸ CCNE1 P24864 3/20 0.40
▸ CDK2 P24941 3/20 0.40
▸ CDK9 P50750 3/20 0.40
▸ CDK5 Q00535 3/20 0.40
▸ CDK5R1 Q15078 3/20 0.40
▸ CCNB3 Q8WWL7 3/20 0.40
▸ PIK3CD O00329 1/20 0.38
▸ PIK3CB P42338 1/20 0.38
▸ MTOR P42345 1/20 0.38
▸ PIK3CG P48736 1/20 0.38
▸ EGFR P00533 2/20 0.38
▸ FGFR1 P11362 2/20 0.38
▸ KDR P35968 2/20 0.38
▸ PTPN11 Q06124 1/20 0.38
▸ TSHR P16473 2/20 0.37

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
SCHEMBL29566622 0.88 HTR1A (0.39) CCNT1CCNB2CCNE2CDK1CCNB1
SCHEMBL24309256 0.88 HTR1A (0.39) CCNT1CCNB2CCNE2CDK1CCNB1
SCHEMBL26651235 0.87 PIK3CG (0.38) PIK3CDPIK3CBMTORPIK3CGEGFR
SCHEMBL29567131 0.87 PIK3CG (0.38) PIK3CDPIK3CBMTORPIK3CGEGFR
SCHEMBL24309349 0.86 PIK3CG (0.42) CCNT1CCNB2CCNE2CDK1CCNB1
SCHEMBL24310735 0.85 PIK3CD (0.39) CCNT1CCNB2CCNE2CDK1CCNB1
SCHEMBL26810218 0.84 KMT2A (0.40) EGFRFGFR1KDRTSHRMAPT
SCHEMBL24310121 0.84 BRD4 (0.39) CCNT1CCNB2CCNE2CDK1CCNB1
SCHEMBL24309545 0.84 TSHR (0.40) PIK3CDPIK3CBMTORPIK3CGEGFR
SCHEMBL24309393 0.84 HTR1A (0.36) CCNT1CCNB2CCNE2CDK1CCNB1

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 6 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
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 CCNT1 4752/4885CCNB2 4859/4885CCNE2 4661/4885

“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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