SCHEMBL1234271

SCHEMBL1234271

CCOC(=O)c1cc(CC(C)(C)O)n(CC)n1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
KMT2A Q03164 5/20 0.41
GAA P10253 1/20 0.41
FAAH O00519 2/20 0.41
CYP1A2 P05177 1/20 0.41
TP53 P04637 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
ADORA3 P0DMS8 1/20 0.38
NR1H2 P55055 1/20 0.38
POLB P06746 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37

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
SCHEMBL731191 0.89 CNR1 (0.43) MAPTKMT2AGAACYP1A2TP53
SCHEMBL1233818 0.88 CNR1 (0.42) MAPTKMT2AGAACYP1A2TP53
SCHEMBL1232784 0.87 CNR2 (0.49) MAPTKMT2AGAACYP1A2
SCHEMBL1233457 0.85 CNR1 (0.43) MAPTKMT2AGAACYP1A2TP53
SCHEMBL1234207 0.85 MAPT (0.45) MAPTKMT2AGAAFAAHCYP1A2
SCHEMBL22412844 0.84 MAPT (0.44) MAPTKMT2AGAAFAAHCYP1A2
SCHEMBL22412805 0.84 MAPT (0.44) MAPTKMT2AGAAFAAHCYP1A2
SCHEMBL13734777 0.81 FAAH (0.36) MAPTKMT2AGAAFAAHCYP1A2
SCHEMBL9468619 0.80 MAPT (0.42) MAPTKMT2AGAAFAAHCYP1A2
SCHEMBL1234127 0.79 AURKA (0.52) MAPTKMT2AGAAFAAHCYP1A2

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
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 MAPT 2501/4885KMT2A 2980/4885GAA 2478/4885
US-20060100229-A1 Pyrazolopyridines and analogs thereof IL4, IL2, IL4I1 MAPT 2197/4885KMT2A 3149/4885GAA 2831/4885
US-20120121651-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF IL4, IL4I1, IL2 MAPT 2501/4885KMT2A 2980/4885GAA 2478/4885
US-20090318435-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF IL4, IL2, IL4I1 MAPT 2197/4885KMT2A 3149/4885GAA 2831/4885

“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.