SCHEMBL3931063

SCHEMBL3931063

CCOP(=O)(OCC)c1ccc2[nH]nc(C=Cc3ccccc3)c2c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AURKA O14965 4/20 0.48
AURKB Q96GD4 2/20 0.48
CHEK1 O14757 12/20 0.47
KDR P35968 8/20 0.46
FGFR1 P11362 1/20 0.46
CDK1 P06493 1/20 0.42
CDK4 P11802 1/20 0.42
CCNA2 P20248 1/20 0.42
CCND1 P24385 1/20 0.42
CDK2 P24941 1/20 0.42
CCND3 P30281 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2B P41595 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
SCHEMBL3931060 1.00 AURKA (0.48) AURKAAURKBCHEK1KDRFGFR1
SCHEMBL3926784 0.89 AURKA (0.49) AURKAAURKBCHEK1KDRFGFR1
SCHEMBL3924607 0.89 AURKA (0.49) AURKAAURKBCHEK1KDRFGFR1
SCHEMBL3924602 0.87 AURKA (0.48) AURKAAURKBCHEK1KDRFGFR1
SCHEMBL3924605 0.87 AURKA (0.48) AURKAAURKBCHEK1KDRFGFR1
SCHEMBL3931206 0.83 AURKA (0.49) AURKAAURKBCHEK1KDRFGFR1
SCHEMBL3931210 0.83 AURKA (0.49) AURKAAURKBCHEK1KDRFGFR1
SCHEMBL27681187 0.81 AURKA (0.54) AURKAAURKBCHEK1KDRFGFR1
SCHEMBL3931064 0.79 AURKA (0.46) AURKAAURKBCHEK1KDRFGFR1
SCHEMBL27681104 0.78 KDR (0.52) AURKAAURKBCHEK1KDRFGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1732938-B1 ORGANOPHOSPHOROUS INDAZOLE DERIVATIVES AND USE THEREOF AS PROTEIN KINASE INHIBITORS AVENTIS PHARMA SA (FR) 2009-05-06 EP claimed
US-7491710-B2 Organophosphorus derivatives of indazoles and use thereof as medicinal products AVENTIS PHARMA S.A. (FR) 2009-02-17 US claimed
EP-1732938-B1 ORGANOPHOSPHOROUS INDAZOLE DERIVATIVES AND USE THEREOF AS PROTEIN KINASE INHIBITORS AVENTIS PHARMA SA (FR) 2009-05-06 EP disclosed
US-7491710-B2 Organophosphorus derivatives of indazoles and use thereof as medicinal products AVENTIS PHARMA S.A. (FR) 2009-02-17 US disclosed
EP-1732938-A1 ORGANOPHOSPHOROUS INDAZOLE DERIVATIVES AND USE THEREOF AS PROTEIN KINASE INHIBITORS Aventis Pharma S.A. (FR) 2006-12-20 EP disclosed
WO-2005058923-A1 ORGANOPHOSPHOROUS INDAZOLE DERIVATIVES AND USE THEREOF AS PROTEIN KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2005-06-30 WO disclosed
US-20050137171-A1 Novel organophosphorus derivatives of indazoles and use thereof as medicinal products AVENTIS PHARMA S.A. (FR) 2005-06-23 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-20050137171-A1 Novel organophosphorus derivatives of indazoles and use thereof as medicinal products PPIP5K2, INPPL1, IP6K3 AURKA 553/4885AURKB 597/4885CHEK1 43/4885

“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.