SCHEMBL2185381

SCHEMBL2185381

N#Cc1cccc(-n2c3ccccc3c3c(-c4cnc5ccccc5c4)cccc32)c1NCCC(N)=O

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MTOR P42345 1/20 0.36
HSP90AA1 P07900 18/20 0.36
PDE10A Q9Y233 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
SCHEMBL2183791 0.88 POLB (0.40) HSP90AA1PDE10A
SCHEMBL2185300 0.87 HSP90AA1 (0.34) MTORHSP90AA1
SCHEMBL2181396 0.84 MEN1 (0.35) HSP90AA1PDE10A
SCHEMBL2182391 0.83 PDGFRB (0.40) MTORHSP90AA1
SCHEMBL2183658 0.79 PDGFRB (0.38) MTORHSP90AA1
SCHEMBL2180152 0.77 HSP90AA1 (0.52) HSP90AA1
SCHEMBL3433972 0.73 PDGFRB (0.38) MTORHSP90AA1
SCHEMBL2183368 0.72 HSP90AA1 (0.49) HSP90AA1
SCHEMBL2181737 0.72 CYP11B1 (0.42) MTORHSP90AA1PDE10A
SCHEMBL2183119 0.72 BIRC5 (0.37) MTORHSP90AA1

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-8309721-B2 HSP90 inhibitory carbazole derivatives, compositions containing same and use thereof SANOFI (FR) 2012-11-13 US disclosed
US-20110166169-A1 NOVEL HSP90 INHIBITORY CARBAZOLE DERIVATIVES, COMPOSITIONS CONTAINING SAME AND USE THEREOF SANOFI-AVENTIS (FR) 2011-07-07 US disclosed
EP-2265598-A2 NOVEL HSP90 INHIBITORY CARBAZOLE DERIVATIVES, COMPOSITIONS CONTAINING SAME, AND USE THEREOF Sanofi-Aventis (FR) 2010-12-29 EP disclosed
WO-2009122034-A2 NOVEL HSP90 INHIBITORY CARBAZOLE DERIVATIVES, COMPOSITIONS CONTAINING SAME, AND USE THEREOF SANOFI-AVENTIS (FR) 2009-10-08 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-20110166169-A1 NOVEL HSP90 INHIBITORY CARBAZOLE DERIVATIVES, COMPOSITIONS CONTAINING SAME AND USE THEREOF HSP90AB2P, HSP90AB1, HSP90AA1 MTOR 2249/4885HSP90AA1 3/4885PDE10A 3590/4885

“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.