SCHEMBL15075702

SCHEMBL15075702

CN1CNc2ncn(CCO)c2CO1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.33
▸ ADORA2B P29275 1/20 0.33
▸ ADORA2A P29274 1/20 0.31
▸ ADORA1 P30542 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
SCHEMBL15075694 0.68 LMNA (0.38) LMNAADORA2BADORA2AADORA1
SCHEMBL15384357 0.61 LMNA (0.37) LMNAADORA2BADORA2AADORA1
SCHEMBL9597539 0.59 ADORA2A (0.37) LMNAADORA2BADORA2AADORA1
SCHEMBL19611492 0.57 FDPS (0.47) LMNAADORA2BADORA2AADORA1
SCHEMBL15075700 0.55 LMNA (0.38) LMNAADORA2BADORA2AADORA1
SCHEMBL15384250 0.54 LMNA (0.36) LMNAADORA2BADORA2AADORA1
SCHEMBL440676 0.54 — —
SCHEMBL17895776 0.54 NPSR1 (0.51) LMNAADORA2BADORA2AADORA1
SCHEMBL9597264 0.53 TRPM5 (0.44) LMNAADORA2AADORA1
Hydrochloric Acid SCHEMBL15436961 0.53 KMT2A (0.60) LMNA

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-20130165427-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CHEMICAL WARFARE AGENT-INDUCED INJURIES HYDRA BIOSCIENCES, INC. (US) 2013-06-27 — — 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-20130165427-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CHEMICAL WARFARE AGENT-INDUCED INJURIES ELANE, CASP3, MMP8 LMNA 594/4885ADORA2B 1599/4885ADORA2A 1507/4885

“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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