SCHEMBL15030872

SCHEMBL15030872

c1ccc(-c2ccc(N3c4ccccc4C4(c5ccccc5Oc5ccccc54)c4cc5c(cc43)c3ccccc3n5-c3ccccc3)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HDAC4 P56524 1/20 0.33
EDNRB P24530 1/20 0.30
EDNRA P25101 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
SCHEMBL15030636 0.97 L3MBTL1 (0.39) KDM4EATML3MBTL1HDAC4
SCHEMBL15030690 0.91 KDM4E (0.36) KDM4EATML3MBTL1HDAC4
SCHEMBL15030792 0.91 KDM4E (0.36) KDM4EATML3MBTL1HDAC4EDNRB
SCHEMBL15030659 0.89 KDM4E (0.38) KDM4EATML3MBTL1HDAC4EDNRB
SCHEMBL16186683 0.89 KDM4E (0.33) KDM4EATML3MBTL1HDAC4
SCHEMBL19977843 0.88 KDM4E (0.38) KDM4EATML3MBTL1EDNRBEDNRA
SCHEMBL19977863 0.88 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL21037677 0.87 KDM4E (0.38) KDM4EATML3MBTL1HDAC4
SCHEMBL15030641 0.86 HDAC4 (0.31) KDM4EATML3MBTL1HDAC4
SCHEMBL15030698 0.86 KDM4E (0.35) KDM4EATML3MBTL1HDAC4EDNRB

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
EP-2780325-B1 SPIRO-DIHYDROACRIDINE DERIVATIVES AND THEIR USE AS MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2016-02-03 EP disclosed
US-20140316134-A1 SPIRO DIHYDROACRIDINE DERIVATIVES AND THE USE THEREOF AS MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2014-10-23 US disclosed
US-20140316134-A1 SPIRO DIHYDROACRIDINE DERIVATIVES AND THE USE THEREOF AS MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2014-10-23 US disclosed
WO-2013083216-A1 SPIRO DIHYDROACRIDINE DERIVATIVES AND THE USE THEREOF AS MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2013-06-13 WO disclosed