SCHEMBL4496683

SCHEMBL4496683

CCCCNc1nn(COCC[Si](C)(C)C)c2cc(Cl)c(-c3ccccc3)cc12

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 1/20 0.35
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.35
CDK1 P06493 1/20 0.34
CDK2 P24941 1/20 0.34
GSK3B P49841 1/20 0.34
KDM4E B2RXH2 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CRHR1 P34998 1/20 0.33
UTS2R Q9UKP6 1/20 0.33
TP53 P04637 2/20 0.33
LMNA P02545 1/20 0.33
CDC7 O00311 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
HPGD P15428 1/20 0.33
SOAT1 P35610 2/20 0.32
GBA1 P04062 1/20 0.32

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
SCHEMBL1234014 0.84 GSK3B (0.52) CDK1CDK2GSK3BKDM4EL3MBTL1
SCHEMBL1234876 0.80 SCN9A (0.36)
SCHEMBL4488611 0.80 GSK3B (0.48) CDK1CDK2GSK3B
SCHEMBL6207856 0.77 KDM4E (0.42) KDM4E
SCHEMBL6478455 0.76 GSK3B (0.53) ALDH1A1CDK1CDK2GSK3BKDM4E
SCHEMBL6486769 0.76 GSK3B (0.60) CDK1CDK2GSK3B
SCHEMBL1462459 0.76 GSK3B (0.54) CDK1CDK2GSK3BKDM4EL3MBTL1
SCHEMBL1460388 0.76 GSK3B (0.52) ALDH1A1CDK1CDK2GSK3BKDM4E
SCHEMBL1461283 0.76 GSK3B (0.54) CDK1CDK2GSK3BKDM4EL3MBTL1
SCHEMBL1461458 0.76 GSK3B (0.48) ALDH1A1CDK1CDK2GSK3BKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1537087-B1 NOVEL AMINOINDAZOLE DERIVATIVES AS MEDICINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AVENTIS PHARMA SA (FR) 2012-11-28 EP disclosed
US-7582669-B2 Aminoindazole derivatives as medicaments and pharmaceutical compositions including them AVENTIS PHARMA SA (FR) 2009-09-01 US disclosed
CN-1982316-A Novel aminoindazole derivatives as medicaments and pharmaceutical compositions including them AVENTIS PHARMA SA (FR) 2007-06-20 CN disclosed
US-20070093479-A1 NOVEL AMINOINDAZOLE DERIVATIVES AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS INCLUDING THEM AVENTIS PHARMA S.A. (FR) 2007-04-26 US disclosed
US-7166629-B2 Aminoindazole derivatives as medicaments and pharmaceutical compositions including them AVENTIS PHARMA S.A. (FR) 2007-01-23 US disclosed
CN-1678589-A Novel aminoindazole derivatives as medicaments and pharmaceutical compositions containing them AVENTIS PHARMA SA (FR) 2005-10-05 CN disclosed
EP-1537087-A1 NOVEL AMINOINDAZOLE DERIVATIVES AS MEDICINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Aventis Pharma S.A. (FR) 2005-06-08 EP disclosed
WO-2004022544-A1 NOVEL AMINOINDAZOLE DERIVATIVES AS MEDICINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AVENTIS PHARMA S.A. (FR) 2004-03-18 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-20070093479-A1 NOVEL AMINOINDAZOLE DERIVATIVES AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS INCLUDING THEM SUCNR1, CNR1, SIGMAR1 ACP1 2603/4885ALDH1A1 1490/4885POLB 4298/4885

“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.