SCHEMBL4245299

SCHEMBL4245299

NC1=C(Cl)C=CC(=O)C1N

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.35

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
SCHEMBL12201063 0.73
Bromide SCHEMBL11510071 0.58 HSP90AA1 (0.35) HSP90AA1
Bromide SCHEMBL11508917 0.58 HSP90AA1 (0.35) HSP90AA1
SCHEMBL28922481 0.55
SCHEMBL801782 0.55 S100A4 (0.36) HSP90AA1
Ethane SCHEMBL11661866 0.51 S100A4 (0.33) HSP90AA1
SCHEMBL6854819 0.51 MEN1 (0.41)
SCHEMBL12235919 0.49
SCHEMBL12706333 0.48
SCHEMBL17131854 0.48 ALDH1A1 (0.31) HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009123969-A2 DEOXYBENZOIN-DERIVED ANTI-FLAMMABLE POLYMERS UNIVERSITY OF MASSACHUSETTS (US) 2009-10-08 WO disclosed