SCHEMBL24309548

SCHEMBL24309548

Cc1ccccc1-c1nc(NS(=O)(=O)c2cnn(C)c2)nc(Oc2cc(C3CCN(C)CC3)ccc2F)c1C(F)(F)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 3/20 0.34
▸ HTR1A P08908 3/20 0.34
▸ HTR7 P34969 3/20 0.34
▸ EGFR P00533 2/20 0.34
▸ JAK2 O60674 1/20 0.33
▸ ALK Q9UM73 1/20 0.33
▸ MAPK7 Q13164 1/20 0.33
▸ PCK1 P35558 1/20 0.33
▸ FLT4 P35916 4/20 0.32
▸ PTK2 Q05397 4/20 0.32
▸ TNK2 Q07912 2/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ PLK1 P53350 1/20 0.32

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
SCHEMBL29566769 1.00 SCN9A (0.34) SCN9AHTR1AHTR7EGFRJAK2
SCHEMBL24309559 0.95 SCN9A (0.36) SCN9AHTR1AHTR7EGFRJAK2
SCHEMBL29567274 0.95 SCN9A (0.36) SCN9AHTR1AHTR7EGFRJAK2
SCHEMBL24309541 0.90 HTR1A (0.34) SCN9AHTR1AHTR7JAK2PCK1
SCHEMBL29567070 0.90 SCN9A (0.40) SCN9AHTR1AHTR7JAK2FLT4
SCHEMBL24310783 0.90 SCN9A (0.40) SCN9AHTR1AHTR7JAK2FLT4
SCHEMBL29566773 0.89 SCN9A (0.34) SCN9AHTR1AHTR7JAK2PCK1
SCHEMBL24309520 0.89 SCN9A (0.35) SCN9AHTR1AHTR7JAK2PCK1
SCHEMBL24309558 0.89 SCN9A (0.34) SCN9AHTR1AHTR7JAK2PCK1
SCHEMBL29566590 0.89 SCN9A (0.35) SCN9AHTR1AHTR7JAK2PCK1

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 SCN9A 385/4885HTR1A 4018/4885HTR7 3833/4885

“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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