SCHEMBL1687672

SCHEMBL1687672

O=c1nc2[nH]c3c(n2c2cccc(Br)c12)=CCCC=3

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SMARCA2 P51531 1/20 0.39
SMARCA4 P51532 1/20 0.39
FEN1 P39748 1/20 0.30

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
SCHEMBL1687540 0.75 KDM4E (0.40) SMARCA2SMARCA4FEN1
SCHEMBL22432353 0.55 FEN1 (0.47) FEN1
SCHEMBL18934882 0.54 KDM4E (0.47)
SCHEMBL16066238 0.53 KDM4E (0.50)
SCHEMBL15846753 0.53 FEN1 (0.49) FEN1
SCHEMBL22904374 0.53 FEN1 (0.41) FEN1
SCHEMBL18934625 0.52 KDM4E (0.38)
SCHEMBL18934521 0.52 KDM4E (0.44)
SCHEMBL31170931 0.52 CDC25B (0.49)
SCHEMBL824371 0.52 CDC25B (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9425409-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2016-08-23 US disclosed
US-9425409-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2016-08-23 US disclosed
US-20130207048-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH PATENTS & SCIENTIFIC INFORMATION (DE) 2013-08-15 US disclosed
US-20130207048-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH PATENTS & SCIENTIFIC INFORMATION (DE) 2013-08-15 US disclosed
WO-2012045384-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-04-12 WO disclosed