SCHEMBL5616985

SCHEMBL5616985

COCCc1nc2cnc3ccccc3c2n1CCCCCC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 11/20 0.44
HDAC6 Q9UBN7 2/20 0.42
FABP4 P15090 1/20 0.42
FABP5 Q01469 1/20 0.42
LTB4R Q15722 3/20 0.41
TBXAS1 P24557 1/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
RAB9A P51151 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL5617047 0.99 TLR7 (0.44) TLR7HDAC6FABP4FABP5TBXAS1
SCHEMBL4148792 0.89 TLR7 (0.46) TLR7HDAC6FABP4FABP5TBXAS1
SCHEMBL4155601 0.89 TLR7 (0.46) TLR7HDAC6FABP4FABP5TBXAS1
SCHEMBL5617118 0.89 FAAH (0.48) TLR7
SCHEMBL4151691 0.88 HDAC6 (0.46) TLR7HDAC6FABP4FABP5TBXAS1
SCHEMBL5616925 0.87 TLR7 (0.48) TLR7
SCHEMBL1949364 0.87 TLR7 (0.47) TLR7MEN1GAAKMT2ARAB9A
SCHEMBL20796926 0.86 SMN1; SMN2 (0.51) TLR7MEN1KMT2A
SCHEMBL30851265 0.86 SMN1; SMN2 (0.51) TLR7MEN1KMT2A
SCHEMBL1952558 0.86 TLR7 (0.49) TLR7MEN1GAAKMT2ARAB9A

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 TLR7 123/4885HDAC6 120/4885FABP4 1729/4885

“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.