SCHEMBL6793005

SCHEMBL6793005

CCOC(=O)c1nn(-c2ccc(OC)cc2)c2c1CCc1cc(O)ccc1-2

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNA2 P20248 7/20 0.65
▸ CDK2 P24941 7/20 0.65
▸ CCNA1 P78396 7/20 0.65
▸ RAD52 P43351 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ PDE4D Q08499 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ TP53 P04637 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ NPBWR1 P48145 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ F2 P00734 1/20 0.45
▸ F10 P00742 1/20 0.45
▸ APP P05067 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ ADORA1 P30542 1/20 0.45
▸ CASP6 P55212 1/20 0.45

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
SCHEMBL6791972 0.89 ALDH1A1 (0.53) CCNA2CDK2CCNA1RAD52ALDH1A1
SCHEMBL6793988 0.86 CCNA2 (0.62) CCNA2CDK2CCNA1RAD52F2
SCHEMBL5371941 0.86 CA9 (0.50) CCNA2CDK2CCNA1RAD52ALDH1A1
SCHEMBL12046675 0.83 CCNA2 (0.55) CCNA2CDK2CCNA1RAD52SMN1; SMN2
SCHEMBL6793613 0.82 CCNA2 (0.52) CCNA2CDK2CCNA1RAD52SMN1; SMN2
SCHEMBL11871559 0.81 RAD52 (0.62) CCNA2CDK2CCNA1RAD52ALDH1A1
SCHEMBL19128204 0.81 CCNA2 (0.54) CCNA2CDK2CCNA1RAD52SMN1; SMN2
SCHEMBL11858649 0.80 RAD52 (0.69) CCNA2CDK2CCNA1RAD52SMN1; SMN2
SCHEMBL12046664 0.80 RAD52 (0.51) CCNA2CDK2CCNA1RAD52SMN1; SMN2
SCHEMBL11867763 0.79 RAD52 (0.70) CCNA2CDK2CCNA1RAD52SMN1; SMN2

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-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 PHARMACIA CORPORATION 2004-07-01 — — US claimed
US-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 PHARMACIA CORPORATION 2004-07-01 — — 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-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 MKNK2, MAPKAPK2, MAP3K2 CCNA2 270/4885CDK2 29/4885CCNA1 527/4885

“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.

Send feedback