SCHEMBL4753949

SCHEMBL4753949

Cc1nc2c[n+]([O-])c3ccccc3c2n1NC(C)C

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TLR7 Q9NYK1 1/20 0.32
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.30
AGER Q15109 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
SCHEMBL4756694 0.80 CNR1 (0.38) LMNASMN1; SMN2TLR7GAAMAPT
SCHEMBL4804117 0.79 TLR8 (0.34) RAB9ATLR7
SCHEMBL10123196 0.79 KDM4E (0.39) NPC1RAB9ALMNATLR7GAA
SCHEMBL2682175 0.78 MAPT (0.37) NPC1RAB9ALMNATLR7GAA
SCHEMBL10734696 0.77 ALDH1A1 (0.40) LMNASMN1; SMN2TLR7MAPTAGER
SCHEMBL10728090 0.75 TSHR (0.41) NPC1RAB9ALMNASMN1; SMN2TLR7
SCHEMBL4756374 0.73 LRRK2 (0.39) LMNASMN1; SMN2TLR7GAAMAPT
SCHEMBL10739285 0.72 TLR7 (0.50) RAB9ALMNASMN1; SMN2TLR7MAPT
SCHEMBL10732400 0.71 PIK3CA (0.47)
SCHEMBL10730689 0.71 MEN1 (0.55) LMNASMN1; SMN2TLR7MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1605943-A4 1-AMINO 1H-IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES CO (US) 2008-01-16 EP disclosed
US-7163947-B2 1-Amino 1H-imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-01-16 US disclosed
EP-1605943-A2 1-AMINO 1H-IMIDAZOQUINOLINES 3M Innovative Properties Company (US) 2005-12-21 EP disclosed
US-20050054640-A1 1-Amino 1H-imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2005-03-10 US disclosed
WO-2004080398-A2 1-AMINO 1H-IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-09-23 WO disclosed
US-20040176367-A1 1-Amino 1H-imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-09-09 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 (2 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-20040176367-A1 1-Amino 1H-imidazoquinolines IL2, IFNG, IL4I1 NPC1 2668/4885RAB9A 2024/4885LMNA 3863/4885
US-20050054640-A1 1-Amino 1H-imidazoquinolines IL2, IFNG, IL4I1 NPC1 2668/4885RAB9A 2024/4885LMNA 3863/4885

“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.