SCHEMBL6477758

SCHEMBL6477758

Nc1n[nH]c2c(F)c(F)c([N+](=O)[O-])cc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNE2 O96020 3/20 0.37
CCNE1 P24864 3/20 0.37
CDK2 P24941 3/20 0.37
CCNT1 O60563 2/20 0.37
CDK4 P11802 2/20 0.37
CCND1 P24385 2/20 0.37
CDK9 P50750 2/20 0.37
CCNB2 O95067 1/20 0.37
CDK1 P06493 1/20 0.37
CCNB1 P14635 1/20 0.37
CCNA2 P20248 1/20 0.37
CDK7 P50613 1/20 0.37
CCNH P51946 1/20 0.37
CCNA1 P78396 1/20 0.37
CCNB3 Q8WWL7 1/20 0.37
MAPT P10636 8/20 0.36
NPSR1 Q6W5P4 2/20 0.36
TDP1 Q9NUW8 5/20 0.36
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 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
SCHEMBL3930568 0.80 MAPT (0.40) CCNE2CCNE1CDK2CCNT1CDK4
SCHEMBL11751133 0.77 TDP1 (0.46) CCNE2CCNE1CDK2CCNT1CDK4
SCHEMBL6478452 0.77 MAPT (0.44) MAPTNPSR1MEN1KMT2APOLB
SCHEMBL10369121 0.75 TDP1 (0.49) CCNE2CCNE1CDK2CCNT1CDK4
SCHEMBL6477902 0.75 ADORA2A (0.40) CCNE2CCNE1CDK2CCNT1CDK4
SCHEMBL15081372 0.74 CCNE2 (0.38) CCNE2CCNE1CDK2CCNT1CDK4
SCHEMBL11747550 0.74 MAPT (0.54) MAPTNPSR1TDP1MEN1KMT2A
SCHEMBL27623436 0.73 DRD2 (0.32)
SCHEMBL6486235 0.73 MAPK1 (0.47) MAPTNPSR1POLBALDH1A1KDM4E
SCHEMBL28252592 0.72 TDP1 (0.48) MAPTTDP1MEN1KMT2APOLB

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-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
US-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof AVENTIS PHARMA S.A. (FR) 2004-01-22 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-20040014802-A1 Aminoindazole derivatives and intermediates, preparation thereof, and pharmaceutical compositions thereof CYP2C8, NR0B2, NR2C2 CCNE2 905/4885CCNE1 1036/4885CDK2 1677/4885

“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.