SCHEMBL5229613

SCHEMBL5229613

CCOC(=O)c1nn(-c2ccc(OC)cc2)c2c1ccc1[nH]ncc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 6/20 0.57
CDK2 P24941 6/20 0.57
CCNA1 P78396 6/20 0.57
APP P05067 2/20 0.52
KDM4E B2RXH2 2/20 0.52
MAPT P10636 2/20 0.52
ALDH1A1 P00352 1/20 0.52
ALOX15 P16050 1/20 0.52
MAPK1 P28482 1/20 0.52
ADORA1 P30542 1/20 0.52
CASP6 P55212 1/20 0.52
HSD17B10 Q99714 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.50
PDE4D Q08499 1/20 0.49
NPBWR1 P48145 2/20 0.46
TDP1 Q9NUW8 1/20 0.44
F10 P00742 1/20 0.43
GABRA1 P14867 1/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42

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
SCHEMBL5228664 0.88 ALDH1A1 (0.52) CCNA2CDK2CCNA1APPKDM4E
SCHEMBL5232468 0.88 CCNA2 (0.46) CCNA2CDK2CCNA1APPKDM4E
SCHEMBL5230295 0.86 CCNA2 (0.53) CCNA2CDK2CCNA1MAPTALDH1A1
SCHEMBL5228781 0.85 CCNA2 (0.54) CCNA2CDK2CCNA1MAPTALDH1A1
SCHEMBL5231857 0.84 CCNA2 (0.46) CCNA2CDK2CCNA1KDM4EALDH1A1
SCHEMBL5229147 0.84 CCNA2 (0.56) CCNA2CDK2CCNA1MAPTALDH1A1
SCHEMBL12886440 0.83 CDK2 (0.46) CCNA2CDK2CCNA1ALDH1A1SMN1; SMN2
SCHEMBL5225870 0.83 CDK2 (0.56) CCNA2CDK2CCNA1ALDH1A1SMN1; SMN2
SCHEMBL5228539 0.79 CCNA2 (0.43) CCNA2CDK2CCNA1MAPTALDH1A1
SCHEMBL5228553 0.79 CDK2 (0.44) CCNA2CDK2CCNA1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050176796-A1 Tricyclic pyrazole derivatives, process for their preparation and their use as antitumor agents PHARMACIA ITALIA S.P.A. (IT) 2005-08-11 US claimed
EP-1478357-B1 TRICYCLIC PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PFIZER ITALIA SRL (IT) 2007-01-31 EP disclosed
US-20050176796-A1 Tricyclic pyrazole derivatives, process for their preparation and their use as antitumor agents PHARMACIA ITALIA S.P.A. (IT) 2005-08-11 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-20050176796-A1 Tricyclic pyrazole derivatives, process for their preparation and their use as antitumor agents TP53, NFATC1, MAP3K15 CCNA2 1338/4885CDK2 178/4885CCNA1 1187/4885

“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.