SCHEMBL4007969

SCHEMBL4007969

C[Si](C)(C)CCOCn1nc(C(=O)O)c2cc([N+](=O)[O-])ccc21

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.45
F2 P00734 5/20 0.45
PLAU P00749 5/20 0.45
CTRB1 P17538 5/20 0.45
KLKB1 P03952 1/20 0.45
CNR2 P34972 3/20 0.43
CNR1 P21554 2/20 0.43
ACHE P22303 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 2/20 0.38
F2RL3 Q96RI0 1/20 0.37

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
SCHEMBL23782916 0.92 ELANE (0.43) ELANEF2PLAUCTRB1KLKB1
SCHEMBL22445983 0.89 ELANE (0.41) ELANEF2PLAUCTRB1KLKB1
SCHEMBL25444558 0.88 CNR2 (0.42) ELANEF2PLAUCTRB1KLKB1
SCHEMBL3517132 0.86 ELANE (0.41) ELANEF2PLAUCTRB1KLKB1
SCHEMBL22446017 0.85 ELANE (0.39) ELANEF2PLAUCTRB1KLKB1
SCHEMBL23783187 0.85 ELANE (0.46) ELANEF2PLAUCTRB1KLKB1
SCHEMBL29643983 0.85 ELANE (0.46) ELANEF2PLAUCTRB1KLKB1
SCHEMBL22446031 0.85 MAPT (0.41) ELANEF2PLAUCTRB1KLKB1
SCHEMBL3517141 0.84 CNR2 (0.45) ELANEF2PLAUCTRB1KLKB1
SCHEMBL2470918 0.84 CNR2 (0.45) ELANEF2PLAUCTRB1KLKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7473701-B2 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2009-01-06 US disclosed
CN-100369899-C Substituted indazoles with anti-cancer activity AVENTIS PHARMA SA (FR) 2008-02-20 CN disclosed
CN-1642922-A Substituted indazoles with anti-cancer activity AVENTIS PHARMA SA (FR) 2005-07-20 CN disclosed
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2005-03-17 US disclosed
US-6858638-B2 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2005-02-22 US disclosed
US-20040106667-A1 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2004-06-03 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 (2 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-20040106667-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 ELANE 3188/4885F2 4207/4885PLAU 3681/4885
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 ELANE 3153/4885F2 4461/4885PLAU 4024/4885

“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.