SCHEMBL3915550

SCHEMBL3915550

CS(=O)(=O)c1nc(N)c2nc[nH]c2n1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 1/20 0.34
▸ LMNA P02545 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ PNP P00491 1/20 0.30
▸ BPTF Q12830 1/20 0.30
▸ FBP1 P09467 1/20 0.30
▸ GDA Q9Y2T3 1/20 0.30

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
SCHEMBL7765652 0.84 TNNI3K (0.34) —
SCHEMBL20567761 0.83 PNP (0.30) PNPGDA
SCHEMBL2730453 0.81 ALOX15 (0.33) GDA
2,6-Diaminopurine SCHEMBL7659157 0.75 GDA (0.41) PNPGDA
SCHEMBL15798374 0.74 CYP1A2 (0.38) SMN1; SMN2
SCHEMBL9118 0.74 NOS1 (0.38) GDA
SCHEMBL3915555 0.73 PDPK1 (0.56) TLR7LMNAPNPGDA
SCHEMBL31713043 0.73 PDPK1 (0.56) TLR7LMNAPNPGDA
SCHEMBL6545701 0.73 GDA (0.34) LMNASMN1; SMN2PNPGDA
SCHEMBL14977060 0.73 GDA (0.33) LMNASMN1; SMN2PNPGDA

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7531162-B2 Transcobalamin receptor binding conjugates useful for treating abnormal cellular proliferation MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2009-05-12 — — US disclosed
EP-1754712-A2 Transcobalamin binding conjugates useful for treating abnormal cellular proliferation MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2007-02-21 — — EP disclosed
US-20060166862-A1 Transcobalamin receptor binding conjugates useful for treating abnormal cellular proliferation REGENTS OF THE UNIVERSITY OF MINNESOTA 2006-07-27 — — US disclosed
EP-1334114-A2 TRANSCOBALAMIN BINDING CONJUGATES USEFUL FOR TREATING ABNORMAL CELLULAR PROLIFERATION MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2003-08-13 — — EP disclosed
US-20020151525-A1 Transcobalamin receptor binding conjugates useful for treating abnormal cellular proliferation COLLINS DOUGLAS A (US) 2002-10-17 — — US disclosed
WO-2002055530-A2 TRANSCOBALAMIN BINDING CONJUGATES USEFUL FOR TREATING ABNORMAL CELLULAR PROLIFERATION MAYO FOUNDATION (US) 2002-07-18 — — WO disclosed
WO-2002042318-A2 TRANSCOBALAMIN RECEPTOR BINDING CONJUGATES FOR NEUTRON CAPTURE THERAPY MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2002-05-30 — — WO disclosed
US-20020049155-A1 Cobalamin compounds useful as cardiovascular agents and as imaging agents HOGENKAMP HENRICUS P C (US) 2002-04-25 — — US disclosed
US-20020042394-A1 Cobalamin compounds useful as antibiotic agents and as imaging agents HOGENKAMP HENRICUS P C (US) 2002-04-11 — — US disclosed
WO-2001092288-A2 COBALAMIN COMPOUNDS USEFUL AS ANTIBIOTIC AGENTS AND AS IMAGING AGENTS MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2001-12-06 — — WO disclosed
WO-2001092283-A2 COBALAMIN COMPOUNDS USEFUL AS CARDIOVASCULAR AGENTS AND AS IMAGING AGENTS MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2001-12-06 — — WO 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 (4 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-20020049155-A1 Cobalamin compounds useful as cardiovascular agents and as imaging agents APOB, MMAB, CBS TLR7 4598/4885LMNA 134/4885SMN1; SMN2 1516/4885
US-20060166862-A1 Transcobalamin receptor binding conjugates useful for treating abnormal cellular proliferation PCNA, MKI67, SLC19A1 TLR7 3711/4885LMNA 262/4885SMN1; SMN2 1690/4885
US-20020151525-A1 Transcobalamin receptor binding conjugates useful for treating abnormal cellular proliferation PCNA, MKI67, SLC19A1 TLR7 3711/4885LMNA 262/4885SMN1; SMN2 1690/4885
US-20020042394-A1 Cobalamin compounds useful as antibiotic agents and as imaging agents MMAB, BLVRB, AHCY TLR7 2273/4885LMNA 1509/4885SMN1; SMN2 2904/4885

“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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