SCHEMBL24310157

SCHEMBL24310157

Cc1ccccc1-c1nc(NS(=O)(=O)c2cnn(C)c2)nc(Oc2ccc(N3CCN(C)CC3)cc2)c1C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAD52 P43351 1/20 0.38
▸ BRD4 O60885 7/20 0.37
▸ JAK2 O60674 4/20 0.36
▸ FLT3 P36888 2/20 0.36
▸ MAP4K1 Q92918 1/20 0.36
▸ PDE2A O00408 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ JAK1 P23458 2/20 0.35
▸ BRD2 P25440 2/20 0.35
▸ JAK3 P52333 2/20 0.35
▸ BRD3 Q15059 2/20 0.35
▸ BRDT Q58F21 2/20 0.35
▸ BUB1B O60566 1/20 0.35
▸ RET P07949 1/20 0.35
▸ WEE1 P30291 1/20 0.35
▸ ALK Q9UM73 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ HPGD P15428 1/20 0.34

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
SCHEMBL29566851 1.00 RAD52 (0.38) RAD52BRD4JAK2FLT3MAP4K1
SCHEMBL24310167 0.94 RAD52 (0.37) RAD52BRD4JAK2FLT3MAP4K1
SCHEMBL29566354 0.94 RAD52 (0.37) RAD52BRD4JAK2FLT3MAP4K1
SCHEMBL29566980 0.92 HTR1A (0.40) RAD52BRD4JAK2FLT3JAK1
SCHEMBL24310151 0.92 HTR1A (0.40) RAD52BRD4JAK2FLT3JAK1
SCHEMBL24310187 0.92 RAD52 (0.36) RAD52BRD4JAK2FLT3MAP4K1
SCHEMBL29566963 0.92 RAD52 (0.36) RAD52BRD4JAK2FLT3MAP4K1
SCHEMBL29567094 0.90 HTR1A (0.38) BRD4ALDH1A1HPGDHTR1AHTR7
SCHEMBL26812633 0.90 HTR1A (0.38) BRD4ALDH1A1HPGDHTR1AHTR7
SCHEMBL24310422 0.89 PDE2A (0.40) RAD52BRD4JAK2MAP4K1PDE2A

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 3 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
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 RAD52 4705/4885BRD4 1716/4885JAK2 3498/4885

“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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