SCHEMBL25231998

SCHEMBL25231998

Cc1nn(C)c(Cl)c1S(=O)(=O)N1CCC(c2cn3ncnc3c(F)c2C)CC1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 16/20 0.72
FPR2 P25090 4/20 0.48
PROKR1 Q8TCW9 4/20 0.48
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CHRM1 P11229 1/20 0.46
CYP2C9 P11712 1/20 0.46

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
SCHEMBL25723627 0.90 CHRM5 (0.69) CHRM5FPR2PROKR1
SCHEMBL25280604 0.88 CHRM5 (0.66) CHRM5FPR2PROKR1CYP3A4CYP2D6
SCHEMBL25723652 0.88 CHRM5 (0.70) CHRM5FPR2PROKR1CYP3A4CYP2D6
SCHEMBL25233149 0.84 CHRM5 (1.00) CHRM5CYP3A4CYP2D6CHRM1CYP2C9
SCHEMBL30457099 0.83 CHRM5 (0.65) CHRM5CYP3A4CYP2D6CHRM1CYP2C9
SCHEMBL25231202 0.83 CHRM5 (0.70) CHRM5CYP3A4CYP2D6CHRM1CYP2C9
SCHEMBL25275827 0.83 CHRM5 (0.82) CHRM5CYP3A4CYP2D6CHRM1CYP2C9
SCHEMBL25229853 0.80 CHRM5 (0.82) CHRM5CYP3A4CYP2D6CHRM1CYP2C9
SCHEMBL25232871 0.79 CHRM5 (0.73) CHRM5FPR2PROKR1CYP3A4CYP2D6
SCHEMBL25233755 0.78 CHRM5 (0.82) CHRM5CYP3A4CYP2D6CHRM1CYP2C9

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-20230183237-A1 COMPETITIVE AND NONCOMPETITIVE INHIBITORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M5 VANDERBILT UNIVERSITY 2023-06-15 US disclosed
US-20230183237-A1 COMPETITIVE AND NONCOMPETITIVE INHIBITORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M5 VANDERBILT UNIVERSITY 2023-06-15 US disclosed
US-20230183237-A1 COMPETITIVE AND NONCOMPETITIVE INHIBITORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M5 VANDERBILT UNIVERSITY 2023-06-15 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-20230183237-A1 COMPETITIVE AND NONCOMPETITIVE INHIBITORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M5 CHRM5, CHRM1, CHRM2 CHRM5 1/4885FPR2 3822/4885PROKR1 1073/4885

“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.