SCHEMBL5617064

SCHEMBL5617064

COCCc1nc2cnc3ccccc3c2n1CCC(=O)N1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TLR7 Q9NYK1 4/20 0.44
NPSR1 Q6W5P4 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
KDM4E B2RXH2 2/20 0.41
GAA P10253 1/20 0.41
PKM P14618 1/20 0.40
POLB P06746 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
FKBP1A P62942 1/20 0.39
SIRT3 Q9NTG7 1/20 0.39

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
SCHEMBL5616910 0.94 MEN1 (0.47) MEN1KMT2ATLR7NPSR1TDP1
SCHEMBL5616939 0.93 MEN1 (0.46) MEN1KMT2ATLR7NPSR1TDP1
SCHEMBL5616906 0.90 NPSR1 (0.44) MEN1KMT2ANPSR1TDP1SMN1; SMN2
SCHEMBL5616913 0.85 NPSR1 (0.42) MEN1KMT2ATLR7NPSR1TDP1
SCHEMBL5617019 0.84 TLR7 (0.60) MEN1KMT2ATLR7
SCHEMBL5617265 0.84 GAA (0.48) MEN1KMT2ANPSR1TDP1SMN1; SMN2
SCHEMBL5617028 0.84 HPGD (0.45) MEN1KMT2ANPSR1TDP1SMN1; SMN2
SCHEMBL5617245 0.83 HPGD (0.47) TLR7NPSR1TDP1SMN1; SMN2KDM4E
SCHEMBL5617029 0.80 LMNA (0.41) MEN1KMT2ATLR7NPSR1TDP1
SCHEMBL5616941 0.80 TLR7 (0.46) TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8697873-B2 Amide substituted imidazopyridines, imidazoquinolines, and imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-04-15 US disclosed
US-20070219196-A1 AMIDE SUBSTITUTED IMIDAZOPYRIDINES, IMIDAZOQUINOLINES, AND IMIDAZONAPHTHYRIDINES SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2007-09-20 US disclosed
EP-1730143-A2 AMIDE SUBSTITUTED IMIDAZOPYRIDINES, IMIDAZOQUINOLINES, AND IMIDAZONAPHTHYRIDINES 3M Innovative Properties Company (US) 2006-12-13 EP disclosed
WO-2005094531-A2 AMIDE SUBSTITUTED IMIDAZOPYRIDINES, IMIDAZOQUINOLINES, AND IMIDAZONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-10-13 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 (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-20070219196-A1 AMIDE SUBSTITUTED IMIDAZOPYRIDINES, IMIDAZOQUINOLINES, AND IMIDAZONAPHTHYRIDINES IL2, IL4, IFNG MEN1 3874/4885KMT2A 2054/4885TLR7 123/4885

“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.