SCHEMBL5618293

SCHEMBL5618293

CCCc1nc2cnc3cccnc3c2n1CCC/C(C)=N/OC

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.37
HPGD P15428 1/20 0.37
ALDH1A1 P00352 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
TP53 P04637 4/20 0.35
GAA P10253 3/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ENPP2 Q13822 1/20 0.34
PDE10A Q9Y233 2/20 0.34
BRD4 O60885 1/20 0.34
LMNA P02545 2/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.32

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
SCHEMBL5618294 1.00 SMN1; SMN2 (0.37) SMN1; SMN2HPGDALDH1A1TLR7TP53
SCHEMBL5618245 0.86 TLR7 (0.42) SMN1; SMN2HPGDTLR7GAAMEN1
SCHEMBL5618033 0.86 TLR7 (0.42) SMN1; SMN2HPGDTLR7GAAMEN1
SCHEMBL5617904 0.86 TP53 (0.41) SMN1; SMN2HPGDALDH1A1TLR7TP53
SCHEMBL5618007 0.83 SMN1; SMN2 (0.38) SMN1; SMN2HPGDALDH1A1TLR7TP53
SCHEMBL5618002 0.83 SMN1; SMN2 (0.38) SMN1; SMN2HPGDALDH1A1TLR7TP53
SCHEMBL5617243 0.83 LMNA (0.43) SMN1; SMN2HPGDALDH1A1TLR7TP53
SCHEMBL3176214 0.82 TLR7 (0.49) SMN1; SMN2HPGDALDH1A1TLR7TP53
SCHEMBL5617263 0.82 TNF (0.45) TP53GAAENPP2LMNA
SCHEMBL5618891 0.81 GAA (0.43) SMN1; SMN2ALDH1A1TLR7TP53GAA

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-8778963-B2 Hydroxylamine and oxime substituted imidazoquinolines, imidazopyridines, and imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-07-15 US disclosed
US-20070099901-A1 Hydroxylamine and oxime substituted imidazoquinolines, imidazopyridines, and imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-03 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-20070099901-A1 Hydroxylamine and oxime substituted imidazoquinolines, imidazopyridines, and imidazonaphthyridines IFNG, IRF3, IDO1 SMN1; SMN2 3106/4885HPGD 27/4885ALDH1A1 679/4885

“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.