SCHEMBL23742020

SCHEMBL23742020

CCCCCC(CCCC)c1cn(C)nc1C

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
COMT P21964 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
SCHEMBL23741993 0.97 MEN1 (0.33) MEN1KMT2ACOMT
SCHEMBL22628373 0.97 MEN1 (0.33) MEN1KMT2ACOMT
SCHEMBL21217055 0.97 MEN1 (0.33) MEN1KMT2ACOMT
SCHEMBL21946577 0.97 KMT2A (0.34) MEN1KMT2ACOMT
SCHEMBL21210837 0.94 MEN1 (0.31) MEN1KMT2ACOMT
SCHEMBL26774679 0.90 MEN1 (0.33) MEN1KMT2ACOMT
SCHEMBL23742021 0.83 MEN1 (0.33) MEN1KMT2ACOMT
SCHEMBL24974206 0.82 GPR84 (0.35) MEN1KMT2A
SCHEMBL21023553 0.82 GPR84 (0.35) MEN1KMT2A
SCHEMBL24908204 0.81 MEN1 (0.33) MEN1KMT2ACOMT

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-20240025877-A1 PROCESSES FOR MAKING MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED 2024-01-25 US disclosed
US-20210246117-A1 PROCESSES FOR MAKING MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS (SAN DIEGO) LLC 2021-08-12 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 (2 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-20210246117-A1 PROCESSES FOR MAKING MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1B, SCNN1G MEN1 4125/4885KMT2A 4802/4885COMT 3306/4885
US-20240025877-A1 PROCESSES FOR MAKING MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1B, SCNN1G MEN1 4316/4885KMT2A 4813/4885COMT 3876/4885

“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.