SCHEMBL30456695

SCHEMBL30456695

[2H]C([2H])([2H])n1cc(S(=O)(=O)Cl)c(C)n1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.38
MEN1 O00255 3/20 0.38
POLB P06746 2/20 0.38
ALDH1A1 P00352 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
FPR2 P25090 1/20 0.33
PROKR1 Q8TCW9 1/20 0.33
GAA P10253 1/20 0.32
NMT1 P30419 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
SCHEMBL2003409 0.86 KMT2A (0.48) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL30456594 0.81 KMT2A (0.30) KMT2A
SCHEMBL30456802 0.75
SCHEMBL14816146 0.70 ADORA2A (0.36) KMT2A
SCHEMBL298837 0.70 ALDH1A1 (0.44) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL2011359 0.69 BRD4 (0.39)
SCHEMBL1642605 0.68 KMT2A (0.49) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL16825437 0.68 DRD2 (0.36) KMT2AMEN1FPR2PROKR1
SCHEMBL4760209 0.67 KMT2A (0.47) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL3145134 0.67 KMT2A (0.48) KMT2AMEN1POLBALDH1A1SMN1; SMN2

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 1 patent. 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

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 KMT2A 1139/4885MEN1 3518/4885POLB 3228/4885

“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.