SCHEMBL6293559

SCHEMBL6293559

N#CC1=C(C2CCNCC2)Nc2n[nH]cc2C1c1ccccc1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CUL4A Q13619 1/20 0.46
KMT2A Q03164 4/20 0.38
KDM4E B2RXH2 3/20 0.38
MEN1 O00255 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.35
KLK7 P49862 1/20 0.35
ABCC4 O15439 2/20 0.35
CACNA1F O60840 2/20 0.35
ABCB11 O95342 2/20 0.35
LMNA P02545 2/20 0.35
CYP1A2 P05177 2/20 0.35
ADORA3 P0DMS8 2/20 0.35
ADORA2A P29274 2/20 0.35
ADORA1 P30542 2/20 0.35
OPRM1 P35372 2/20 0.35
SCN1A P35498 2/20 0.35
HTR2B P41595 2/20 0.35
CACNA1D Q01668 2/20 0.35

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
SCHEMBL6293536 0.94 CUL4A (0.49) CUL4AKMT2AKDM4EMEN1TDP1
SCHEMBL6292393 0.88 CUL4A (0.43) CUL4AKMT2AKDM4EMEN1TDP1
SCHEMBL6296537 0.84 GSK3B (0.33) KDM4EALDH1A1MAPTHTR2CSMN1; SMN2
SCHEMBL8344295 0.83 HTR2C (0.45) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL6221768 0.83 HTR1A (0.37) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL6296527 0.83 GSK3B (0.36) KDM4EALDH1A1MAPTHTR2CSMN1; SMN2
Hydrochloric Acid SCHEMBL6296797 0.82 HTR1A (0.36) KMT2AKDM4EMEN1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL6296665 0.82 GSK3B (0.36) KDM4EALDH1A1MAPTHTR2CSMN1; SMN2
Hydrochloric Acid SCHEMBL6220172 0.82 EEF2K (0.40) MAPTHTR2CCACNA1BAPBA1SMN1; SMN2
SCHEMBL6297315 0.81 SLC18A3 (0.39) CUL4AKDM4EALDH1A1MAPTLMNA

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 2 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

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 CUL4A 3202/4885KMT2A 3396/4885KDM4E 1992/4885

“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.