SCHEMBL6486235

SCHEMBL6486235

CC(Nc1c([N+](=O)[O-])cc2c(N)n[nH]c2c1F)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 8/20 0.47
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 4/20 0.39
HTT P42858 2/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 4/20 0.39
HTR6 P50406 1/20 0.38
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL6885589 0.82 MAPK1 (0.39) MAPK1CRHBPCRHR2SMN1; SMN2ALDH1A1
SCHEMBL1460389 0.81 GSK3B (0.53) MAPK1ALDH1A1HTTMAPTNPSR1
SCHEMBL6477758 0.73 CCNE2 (0.37) MAPK1ALDH1A1MAPTPOLBKDM4E
SCHEMBL6885593 0.73 MAPT (0.36) MAPK1SMN1; SMN2ALDH1A1GAAMAPT
SCHEMBL6630143 0.72 GSK3B (0.57)
SCHEMBL9398104 0.69 CRHBP (0.52) CRHBPCRHR2HPGDSMN1; SMN2ALDH1A1
SCHEMBL5021179 0.68 ALDH1A1 (0.62) MAPK1CRHBPCRHR2HPGDSMN1; SMN2
SCHEMBL10589261 0.65 GALR3 (0.49) MAPK1CRHBPCRHR2SMN1; SMN2ALDH1A1
SCHEMBL1417967 0.65 EGFR (0.57) CRHBPCRHR2ALDH1A1HTTGAA
SCHEMBL1417970 0.65 EGFR (0.57) CRHBPCRHR2ALDH1A1HTTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6949579-B2 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2005-09-27 US claimed
US-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2004-01-22 US claimed
EP-1487804-B1 AMINOINDAZOLE DERIVATIVES AS PROTEIN-KINASE INHIBITORS AVENTIS PHARMA SA (FR) 2014-02-26 EP disclosed
US-6949579-B2 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2005-09-27 US disclosed
EP-1487804-A2 AMINOINDAZOLE DERIVATIVES AS PROTEIN-KINASE INHIBITORS Aventis Pharma S.A. (FR) 2004-12-22 EP disclosed
WO-2003078403-A2 DERIVES D’AMINOINDAZOLES COMME INHIBITEURS DE PROTEINE-KINASE AVENTIS PHARMA S.A. (FR) 2003-09-25 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-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof CYP2C8, NR0B2, NR2C2 MAPK1 3184/4885CRHBP 3174/4885CRHR2 280/4885

“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.