SCHEMBL4501135

SCHEMBL4501135

CCCC(=O)Nc1nn(COCC[Si](C)(C)C)c2cc(Cl)ccc12.c1cc2cc-2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 11/20 0.41
KDM4E B2RXH2 2/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GSK3A P49840 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
CYP1A2 P05177 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
ADORA1 P30542 1/20 0.36
KMO O15229 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 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
SCHEMBL1235039 0.94 GSK3B (0.46) GSK3BKDM4EATML3MBTL1CASP3
SCHEMBL1462473 0.92 GSK3B (0.42) GSK3BKDM4EATML3MBTL1GSK3A
SCHEMBL6478333 0.89 GSK3B (0.51) GSK3BKDM4EATML3MBTL1CYP1A2
SCHEMBL6491490 0.89 GSK3B (0.49) GSK3BKDM4EATML3MBTL1GSK3A
SCHEMBL1462452 0.85 ADORA3 (0.42) GSK3BKDM4EATML3MBTL1GSK3A
SCHEMBL1461546 0.85 GSK3B (0.53) GSK3BKDM4EATML3MBTL1GSK3A
SCHEMBL6478549 0.85 GSK3B (0.53) GSK3BKDM4EATML3MBTL1GSK3A
SCHEMBL1462476 0.84 GSK3B (0.40) GSK3BKDM4EATML3MBTL1GSK3A
SCHEMBL1461577 0.84 GSK3B (0.50) GSK3BKDM4EATML3MBTL1GSK3A
SCHEMBL6478417 0.84 GSK3B (0.50) GSK3BKDM4EATML3MBTL1GSK3A

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-7582669-B2 Aminoindazole derivatives as medicaments and pharmaceutical compositions including them AVENTIS PHARMA SA (FR) 2009-09-01 US disclosed
US-20070093479-A1 NOVEL AMINOINDAZOLE DERIVATIVES AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS INCLUDING THEM AVENTIS PHARMA S.A. (FR) 2007-04-26 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-20070093479-A1 NOVEL AMINOINDAZOLE DERIVATIVES AS MEDICAMENTS AND PHARMACEUTICAL COMPOSITIONS INCLUDING THEM SUCNR1, CNR1, SIGMAR1 GSK3B 3594/4885KDM4E 4063/4885ATM 3946/4885

“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.