SCHEMBL1233968

SCHEMBL1233968

Cn1nc(C(N)=O)cc1CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
TSHR P16473 1/20 0.42
PLA2G10 O15496 3/20 0.42
HPGD P15428 2/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 1/20 0.41
RECQL P46063 1/20 0.41
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
ELANE P08246 1/20 0.39
MEN1 O00255 2/20 0.39
PKM P14618 1/20 0.39
GRM5 P41594 1/20 0.39
GAA P10253 1/20 0.39
ALOX15 P16050 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPK1 P28482 1/20 0.38
HDAC4 P56524 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
SCHEMBL1234020 0.88 ALDH1A1 (0.44) ALDH1A1TSHRPLA2G10HPGDMAPT
SCHEMBL1232705 0.88 KMT2A (0.48) ALDH1A1TSHRHPGDPOLBKMT2A
SCHEMBL1233755 0.82 GABRP (0.45) ALDH1A1TSHRHPGDKMT2AMAPT
SCHEMBL8138643 0.77 ALDH1A1 (0.44) ALDH1A1TSHRHPGDKMT2AMAPT
SCHEMBL1234036 0.77 ALDH1A1 (0.42) ALDH1A1TSHRMAPTPKMHSD17B10
SCHEMBL1233324 0.76 ALDH1A1 (0.41) ALDH1A1TSHRKMT2AMAPTMEN1
SCHEMBL1234466 0.76 ALDH1A1 (0.45) ALDH1A1TSHRHPGDMAPTCA12
SCHEMBL30385642 0.74 RIPK1 (0.47) ALDH1A1PLA2G10KMT2AMEN1HSD17B10
SCHEMBL1233486 0.74 MAPT (0.45) ALDH1A1TSHRHPGDKMT2AMAPT
SCHEMBL6825782 0.73 PLA2G10 (0.45) ALDH1A1PLA2G10HPGDPOLBMAPT

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 ALDH1A1 1406/4885TSHR 2486/4885PLA2G10 3645/4885
US-20060100229-A1 Pyrazolopyridines and analogs thereof IL4, IL2, IL4I1 ALDH1A1 1688/4885TSHR 2069/4885PLA2G10 3690/4885
US-20120121651-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF IL4, IL4I1, IL2 ALDH1A1 1406/4885TSHR 2486/4885PLA2G10 3645/4885
US-20090318435-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF IL4, IL2, IL4I1 ALDH1A1 1688/4885TSHR 2069/4885PLA2G10 3690/4885

“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.