SCHEMBL1233974

SCHEMBL1233974

CCCCn1nc(C#N)c(-c2ccccc2N)c1C(CC)S(=O)(=O)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
SAE1 Q9UBE0 1/20 0.32
UBA2 Q9UBT2 1/20 0.32
GCGR P47871 1/20 0.31
MMP1 P03956 3/20 0.31
MMP7 P09237 3/20 0.31
MMP12 P39900 3/20 0.31
MMP13 P45452 3/20 0.31
ACE P12821 2/20 0.31
USP8 P40818 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
SCHEMBL1233449 0.82 TP53 (0.36) KDM4EMEN1ALDH1A1TP53MAPT
SCHEMBL1233973 0.78 SMN1; SMN2 (0.32) ALDH1A1TP53HTTSAE1UBA2
SCHEMBL1234246 0.76 GCGR (0.38) KDM4EALDH1A1MAPTSAE1UBA2
SCHEMBL1232444 0.72 KDM4E (0.40) KDM4EMEN1ALDH1A1TP53MAPT
SCHEMBL1232513 0.70 GRK6 (0.34) KDM4EALDH1A1MAPTSAE1UBA2
SCHEMBL1231873 0.69 TLR7 (0.47) MEN1MAPTKMT2ASAE1UBA2
SCHEMBL1234333 0.66 SMPD1 (0.41) KDM4EALDH1A1MMP1MMP7MMP12
SCHEMBL1232631 0.65 SMPD1 (0.42) KDM4EALDH1A1MMP1MMP7MMP12
SCHEMBL1234069 0.65 GCGR (0.34) KDM4EALDH1A1MAPTSAE1UBA2
SCHEMBL1233552 0.64 CYP11B2 (0.36) KDM4EMEN1ALDH1A1TP53MAPT

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 11 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
EP-1696912-A4 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES CO (US) 2009-06-03 EP disclosed
US-20090075980-A1 Pyrazolopyridines and Analogs Thereof COLEY PHARMACEUTICAL GROUP, INC. (US) 2009-03-19 US disclosed
EP-1696912-A2 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M Innovative Properties Company (US) 2006-09-06 EP disclosed
US-20060100229-A1 Pyrazolopyridines and analogs thereof 3M INNOVATIVE PROPERTIES COMPANY 2006-05-11 US disclosed
WO-2005079195-A2 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-09-01 WO 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 KDM4E 1465/4885MEN1 2523/4885ALDH1A1 1406/4885
US-20060100229-A1 Pyrazolopyridines and analogs thereof IL4, IL2, IL4I1 KDM4E 1735/4885MEN1 2683/4885ALDH1A1 1688/4885
US-20120121651-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF IL4, IL4I1, IL2 KDM4E 1465/4885MEN1 2523/4885ALDH1A1 1406/4885
US-20090318435-A1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF IL4, IL2, IL4I1 KDM4E 1735/4885MEN1 2683/4885ALDH1A1 1688/4885

“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.