SCHEMBL26937985

SCHEMBL26937985

Cc1nn2c(c1C(C)C)CCC2

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 1/20 0.33
THRB P10828 4/20 0.32
TGFBR1 P36897 4/20 0.32
MAPK14 Q16539 2/20 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
SCHEMBL20411228 0.79 KDM5B (0.32) KDM5BTHRBTGFBR1MAPK14
SCHEMBL25632354 0.77 KDM5B (0.31) KDM5B
SCHEMBL15912316 0.76 KDM5B (0.34) KDM5B
SCHEMBL13075463 0.75 THRB (0.35) THRBTGFBR1MAPK14
SCHEMBL25985962 0.75 KDM5B (0.33) KDM5B
SCHEMBL22421091 0.74 MAP3K14 (0.31)
SCHEMBL20993428 0.74 KDM5B (0.33) KDM5B
SCHEMBL27336699 0.73 LIPE (0.31)
SCHEMBL19099498 0.73 PDE5A (0.32) KDM5BTHRBTGFBR1MAPK14
SCHEMBL24744542 0.72 THRB (0.33) THRBTGFBR1MAPK14

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-20230399319-A1 Acylsulfamide Compound and Pharmaceutical Use Therefor JAPAN TOBACCO INC. (JP) 2023-12-14 US disclosed
US-20230399319-A1 Acylsulfamide Compound and Pharmaceutical Use Therefor JAPAN TOBACCO INC. (JP) 2023-12-14 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-20230399319-A1 Acylsulfamide Compound and Pharmaceutical Use Therefor NLRP3, NLRP1, NOD1 KDM5B 3998/4885THRB 3819/4885TGFBR1 2807/4885

“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.