SCHEMBL4753495

SCHEMBL4753495

CCOCc1nc2cnc3cc(OCc4ccccc4)ccc3c2n1N

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 3/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
GLA P06280 1/20 0.43
CYP3A4 P08684 2/20 0.41
GAA P10253 2/20 0.41
GRM4 Q14833 1/20 0.40
ACSS2 Q9NR19 1/20 0.39
NMT1 P30419 3/20 0.39
NMT2 O60551 1/20 0.39
KIT P10721 1/20 0.39
ALOX5 P09917 1/20 0.39
PDGFRB P09619 1/20 0.38
PDGFRA P16234 1/20 0.38
DYRK1A Q13627 1/20 0.38
MEN1 O00255 1/20 0.38
HSP90AA1 P07900 1/20 0.38

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
SCHEMBL1486639 0.84 TLR7 (0.46) KMT2ACYP3A4GRM4ACSS2DYRK1A
SCHEMBL1486507 0.84 TLR7 (0.47) SMN1; SMN2MAPTKMT2ACYP3A4GRM4
SCHEMBL4757634 0.83 CYP3A4 (0.38) MAPTKMT2ACYP3A4GRM4ACSS2
SCHEMBL4757632 0.83 NMT1 (0.39) KMT2ACYP3A4GRM4ACSS2NMT1
SCHEMBL4757662 0.83 ACSS2 (0.38) MAPTKMT2ACYP3A4GRM4ACSS2
SCHEMBL5420192 0.83 NMT1 (0.44) SMN1; SMN2RAB9AKMT2ANMT1NMT2
Hydrochloric Acid SCHEMBL1486765 0.83 TLR8 (0.43) SMN1; SMN2RAB9AMAPTKMT2ACYP3A4
SCHEMBL1486772 0.82 TLR7 (0.54) CYP3A4GRM4ACSS2NMT1NMT2
SCHEMBL4756005 0.82 TLR7 (0.46) SMN1; SMN2RAB9ANPC1MAPTKMT2A
SCHEMBL4757142 0.80 TLR7 (0.49) KMT2AACSS2NMT1NMT2MEN1

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 7 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
WO-2006028451-A1 1-AMINO 1-H-IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-16 WO 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 SMN1; SMN2 2646/4885RAB9A 2024/4885NPC1 2668/4885
US-20050054640-A1 1-Amino 1H-imidazoquinolines IL2, IFNG, IL4I1 SMN1; SMN2 2646/4885RAB9A 2024/4885NPC1 2668/4885

“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.