SCHEMBL4006501

SCHEMBL4006501

C#Cc1nn(COCC[Si](C)(C)C)c2ccc([N+](=O)[O-])cc12.c1cc2cc-2c1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.41
CNR1 P21554 6/20 0.41
ACHE P22303 5/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
F2RL3 Q96RI0 5/20 0.39
ELANE P08246 1/20 0.37
MAPT P10636 4/20 0.35
MEN1 O00255 2/20 0.35
LMNA P02545 2/20 0.35
KMT2A Q03164 2/20 0.35
F2R P25116 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PGR P06401 1/20 0.34

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
SCHEMBL14442048 0.84 ELANE (0.47) CNR2CNR1ACHEL3MBTL1F2RL3
SCHEMBL4006988 0.83 NPC1 (0.34) CNR2CNR1ACHE
Pyridine SCHEMBL5206041 0.82 CNR2 (0.35) CNR2CNR1ACHEL3MBTL1F2RL3
SCHEMBL3513839 0.82 CNR2 (0.42) CNR2CNR1ACHEL3MBTL1F2RL3
SCHEMBL5518753 0.81 L3MBTL1 (0.58) CNR2CNR1ACHEL3MBTL1F2RL3
SCHEMBL3514358 0.80 CNR2 (0.39) CNR2CNR1ACHEL3MBTL1F2RL3
SCHEMBL2470918 0.79 CNR2 (0.45) CNR2CNR1ACHEL3MBTL1F2RL3
SCHEMBL30183407 0.79 CNR2 (0.45) CNR2CNR1ACHEL3MBTL1F2RL3
SCHEMBL29644071 0.79 CNR2 (0.45) CNR2CNR1ACHEL3MBTL1F2RL3
SCHEMBL3517141 0.79 CNR2 (0.45) CNR2CNR1ACHEL3MBTL1F2RL3

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 4 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
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 CNR2 2155/4885CNR1 2219/4885ACHE 2085/4885
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 CNR2 2663/4885CNR1 2997/4885ACHE 3170/4885

“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.