SCHEMBL6293389

SCHEMBL6293389

CCCC1=C(C#N)C(c2cccc(C)c2[N+](=O)[O-])c2c[nH]nc2N1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 1/20 0.34
ALDH1A1 P00352 5/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 2/20 0.32
CUL4A Q13619 1/20 0.32
CSNK2A1 P68400 2/20 0.31
CSNK2B P67870 1/20 0.31
ALOX15 P16050 4/20 0.31
HSD17B10 Q99714 3/20 0.31
TP53 P04637 2/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
AKR1C3 P42330 1/20 0.31
AKR1C1 Q04828 1/20 0.31
KDM4E B2RXH2 2/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TLR7 Q9NYK1 1/20 0.30
MET P08581 1/20 0.30
POLB P06746 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
SCHEMBL6292345 0.85 CUL4A (0.47) NR3C2ALDH1A1TDP1LMNACUL4A
SCHEMBL6296757 0.85 ALDH1A1 (0.43) NR3C2ALDH1A1LMNAALOX15HSD17B10
SCHEMBL6297468 0.84 CUL4A (0.38) NR3C2ALDH1A1TDP1CUL4AAKR1C3
SCHEMBL6293447 0.84 CUL4A (0.38) NR3C2ALDH1A1TDP1LMNACUL4A
SCHEMBL6293430 0.83 ALDH1A1 (0.35) ALDH1A1TDP1CUL4AALOX15HSD17B10
SCHEMBL6293672 0.82 ALDH1A1 (0.34) ALDH1A1TDP1CUL4AALOX15HSD17B10
SCHEMBL6297368 0.79 HSD17B10 (0.36) NR3C2ALDH1A1LMNAALOX15HSD17B10
SCHEMBL6292239 0.78 NR3C2 (0.40) NR3C2ALDH1A1LMNAALOX15HSD17B10
SCHEMBL6296586 0.78 ALDH1A1 (0.35) NR3C2ALDH1A1LMNAALOX15HSD17B10
SCHEMBL6297275 0.78 CDK1 (0.40) NR3C2ALDH1A1LMNAALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6977262-B2 Dihydropyrazolopyridine compounds and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2005-12-20 US disclosed
US-20040052822-A1 Dihydropyrazolopyridine compounds and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2004-03-18 US disclosed
EP-1355909-A2 DIHYDROPYRAZOLOPYRIDINE COMPOUNDS AND PHARMACEUTICAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2003-10-29 EP disclosed
WO-2002062795-A9 DIHYDROPYRAZOLOPYRIDINE COMPOUNDS AND PHARMACEUTICAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2002-10-10 WO disclosed
WO-2002062795-A2 DIHYDROPYRAZOLOPYRIDINE COMPOUNDS AND PHARMACEUTICAL USE THEREOF MITSUBISHI PHARMA CORPORATION (JP) 2002-08-15 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 (1 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-20040052822-A1 Dihydropyrazolopyridine compounds and pharmaceutical use thereof GSK3B, GSK3A, PYGB NR3C2 2858/4885ALDH1A1 944/4885TDP1 550/4885

“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.