SCHEMBL26810527

SCHEMBL26810527

Cn1cc(S(=O)(=O)Nc2nc(OCCC(C)(C)O)cc(C3CC3(C)C)n2)cn1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 6/20 0.35
▸ HTR7 P34969 6/20 0.35
▸ PIK3CG P48736 3/20 0.34
▸ PIK3CD O00329 2/20 0.34
▸ PIK3CB P42338 2/20 0.34
▸ PARG Q86W56 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ ACVR2A P27037 1/20 0.33
▸ TGFBR2 P37173 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ NLRP3 Q96P20 1/20 0.32
▸ PIK3CA P42336 2/20 0.32
▸ KIF18A Q8NI77 1/20 0.32
▸ DRD2 P14416 1/20 0.31
▸ HTR6 P50406 1/20 0.31
▸ JAK1 P23458 1/20 0.31
▸ MTOR P42345 1/20 0.31
▸ PIK3C3 Q8NEB9 1/20 0.31

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
SCHEMBL24309973 0.90 HTR1A (0.34) HTR1AHTR7PIK3CGPIK3CDPIK3CB
SCHEMBL24310778 0.88 HTR1A (0.40) HTR1AHTR7PIK3CGPIK3CDPIK3CB
SCHEMBL26811230 0.86 HTR1A (0.37) HTR1AHTR7PIK3CGPIK3CDPIK3CB
SCHEMBL26811193 0.86 HTR1A (0.36) HTR1AHTR7PIK3CGPIK3CDPIK3CB
SCHEMBL24309972 0.84 PIK3CG (0.38) HTR1AHTR7PIK3CGPIK3CDPIK3CB
SCHEMBL26810493 0.81 PIK3CG (0.34) HTR1AHTR7PIK3CGPIK3CDPIK3CB
SCHEMBL26811264 0.80 PIK3CG (0.38) HTR1AHTR7PIK3CGPIK3CDPIK3CB
SCHEMBL24309971 0.80 PARG (0.32) HTR1AHTR7PIK3CGPIK3CDPIK3CB
SCHEMBL29566657 0.80 PIK3CG (0.41) HTR1AHTR7PIK3CGPIK3CDPIK3CB
SCHEMBL26806504 0.80 PIK3CG (0.41) HTR1AHTR7PIK3CGPIK3CDPIK3CB

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 2 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

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 HTR1A 4018/4885HTR7 3833/4885PIK3CG 533/4885

“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.

Send feedback