SCHEMBL2458642

SCHEMBL2458642

CN(C)S(=O)(=O)c1nc(N2CCCCC2)c2nc(N(OCCO)OCCO)nc(N3CCCCC3)c2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 14/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ PDE2A O00408 1/20 0.46
▸ RGS12 O14924 1/20 0.46
▸ SLC22A2 O15244 1/20 0.46
▸ SLC22A1 O15245 1/20 0.46
▸ ABCC4 O15439 1/20 0.46
▸ ABCC5 O15440 1/20 0.46
▸ PDE6D O43924 1/20 0.46
▸ PDE8A O60658 1/20 0.46
▸ GMNN O75496 1/20 0.46
▸ USP2 O75604 1/20 0.46
▸ PDE5A O76074 1/20 0.46
▸ ABCB11 O95342 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 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
SCHEMBL141542 0.85 SLC29A1 (0.61) SLC29A1MEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL2456665 0.81 SLC29A1 (0.51) SLC29A1MEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL15065644 0.79 SLC29A1 (0.55) SLC29A1MEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL7446848 0.78 SLC29A1 (0.53) SLC29A1MEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL9565600 0.78 SLC29A1 (0.53) SLC29A1MEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL2458640 0.77 SLC29A1 (0.41) SLC29A1MEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL4417277 0.73 SLC29A1 (0.47) SLC29A1MEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL4077877 0.73 SLC29A1 (0.47) SLC29A1MEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL2456479 0.72 SLC29A1 (0.43) SLC29A1MEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL10038311 0.70 SLC29A1 (0.75) SLC29A1MEN1KMT2ASMN1; SMN2NPSR1

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-20110224128-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF MUSCULAR DYSTROPHY WHALEN ANNE 2011-09-15 — — 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-20110224128-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF MUSCULAR DYSTROPHY PYGM, TNNC1, MYOF SLC29A1 3650/4885MEN1 4550/4885KMT2A 1985/4885

“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.

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