SCHEMBL19542267

SCHEMBL19542267

CN1C(=O)c2c(ncn2CCOCCOCCn2cnc3c2c(=O)n(C)c(=O)n3C)N(C)C1O

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 P30542 1/20 0.55
▸ ADORA2B P29275 8/20 0.54
▸ LMNA P02545 2/20 0.51
▸ RXFP1 Q9HBX9 4/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ MAPT P10636 1/20 0.48
▸ ADORA2A P29274 1/20 0.47
▸ MAPK1 P28482 1/20 0.46
▸ KMT2A Q03164 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
SCHEMBL21766238 0.89 ADORA2B (0.58) ADORA2BLMNARXFP1SMN1; SMN2MAPT
SCHEMBL17744966 0.82 ADORA1 (0.75) ADORA1ADORA2BLMNARXFP1MAPT
SCHEMBL19499802 0.80 ADORA1 (0.61) ADORA1ADORA2BLMNARXFP1SMN1; SMN2
SCHEMBL17748272 0.77 ADORA1 (0.76) ADORA1ADORA2BLMNARXFP1MAPT
SCHEMBL19499799 0.77 ADORA1 (0.62) ADORA1ADORA2BLMNARXFP1SMN1; SMN2
SCHEMBL16120984 0.71 ADORA2B (0.81) ADORA1ADORA2BLMNARXFP1SMN1; SMN2
SCHEMBL18175139 0.71 ADORA2B (0.71) ADORA1ADORA2BLMNARXFP1SMN1; SMN2
SCHEMBL28025751 0.70 ADORA2B (1.00) ADORA2BLMNARXFP1SMN1; SMN2MAPT
SCHEMBL19472287 0.70 AMPD2 (0.38) ADORA2BLMNAADORA2AKMT2A
Etofylline SCHEMBL149271 0.69 ADORA2B (1.00) ADORA2BLMNARXFP1SMN1; SMN2MAPT

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-10226467-B2 Compounds for the treatment of myotonic dystrophy UNIVERSITAT DE VALENCIA (ES) 2019-03-12 — — US disclosed
US-20170312285-A1 COMPOUNDS FOR THE TREATMENT OF MYOTONIC DYSTROPHY SELABTEC SCIENCES, SL (ES) 2017-11-02 — — 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-20170312285-A1 COMPOUNDS FOR THE TREATMENT OF MYOTONIC DYSTROPHY SMN1; SMN2, CPT1B, MTPN ADORA1 790/4885ADORA2B 1199/4885LMNA 433/4885
US-10226467-B2 Compounds for the treatment of myotonic dystrophy SMN1; SMN2, CPT1B, MTPN ADORA1 790/4885ADORA2B 1199/4885LMNA 433/4885

“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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