SCHEMBL1233962

SCHEMBL1233962

CCn1nc2c(N)nc3ccccc3c2c1CC(C)(C)NC(=O)C1CC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
TLR7 Q9NYK1 8/20 0.35
TLR8 Q9NR97 5/20 0.35
MAPT P10636 1/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
GAA P10253 2/20 0.35
HPGD P15428 1/20 0.35
SSTR4 P31391 1/20 0.35
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TP53 P04637 1/20 0.34
ACACB O00763 1/20 0.34

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
SCHEMBL1233718 0.93 TLR7 (0.37) SMN1; SMN2TLR7TLR8MAPTALDH1A1
SCHEMBL1232630 0.89 GAA (0.39) SMN1; SMN2TLR7TLR8MAPTALDH1A1
SCHEMBL1232877 0.89 KDM4E (0.37) SMN1; SMN2TLR7MAPTALDH1A1KDM4E
SCHEMBL1234382 0.89 TLR7 (0.37) TLR7TLR8GAA
SCHEMBL1233754 0.88 TLR7 (0.39) TLR7TLR8
SCHEMBL1233964 0.84 TLR7 (0.36) TLR7TLR8
SCHEMBL1234711 0.83 ADORA3 (0.38) SMN1; SMN2TLR7TLR8ALDH1A1KDM4E
SCHEMBL1234569 0.82 EGFR (0.45) SMN1; SMN2TLR7TLR8MAPTALDH1A1
SCHEMBL1234343 0.81 TLR7 (0.39) TLR7TLR8KDM4E
SCHEMBL1234684 0.80 TLR7 (0.45) SMN1; SMN2TLR7TLR8MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1696912-B1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES CO (US) 2016-05-11 EP disclosed
US-9145410-B2 Pyrazolopyridines and analogs thereof 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-09-29 US disclosed
US-20120121651-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES COMPANY 2012-05-17 US disclosed
US-7879849-B2 such as 1-(2-Methylpropyl)-2-propyl-2H-pyrazolo[3,4-c]quinolin-4-amine, used as immunomodulators, for inducing or inhibiting cytokine biosynthesis in animals and in the treatment of viral and neoplastic diseases 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-02-01 US disclosed
US-20090318435-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES COMPANY 2009-12-24 US disclosed
US-7544697-B2 Pyrazolopyridines and analogs thereof COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-06-09 US disclosed
US-20090075980-A1 Pyrazolopyridines and Analogs Thereof COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-03-19 US disclosed
US-20060100229-A1 Pyrazolopyridines and analogs thereof 3M INNOVATIVE PROPERTIES COMPANY 2006-05-11 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 (4 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-20090075980-A1 Pyrazolopyridines and Analogs Thereof IL4, IL4I1, IL2 SMN1; SMN2 3916/4885TLR7 265/4885TLR8 457/4885
US-20060100229-A1 Pyrazolopyridines and analogs thereof IL4, IL2, IL4I1 SMN1; SMN2 4015/4885TLR7 179/4885TLR8 319/4885
US-20120121651-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF IL4, IL4I1, IL2 SMN1; SMN2 3916/4885TLR7 265/4885TLR8 457/4885
US-20090318435-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF IL4, IL2, IL4I1 SMN1; SMN2 4015/4885TLR7 179/4885TLR8 319/4885

“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.