SCHEMBL16158683

SCHEMBL16158683

CC1(C)c2cc(-c3cccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)c3)ccc2Oc2ccc(-c3cccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)c3)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.48
KMT2A Q03164 10/20 0.48
MAPT P10636 8/20 0.48
ALDH1A1 P00352 7/20 0.48
HPGD P15428 7/20 0.48
KDM4E B2RXH2 6/20 0.48
LMNA P02545 2/20 0.48
GLA P06280 1/20 0.48
NTSR1 P30989 1/20 0.46
ADORA2A P29274 4/20 0.42
ADORA1 P30542 4/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
CYP2C19 P33261 1/20 0.42
ADORA3 P0DMS8 2/20 0.41
MAOB P27338 3/20 0.40
MAOA P21397 2/20 0.40
BRD4 O60885 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL16158765 0.96 MEN1 (0.45) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL16158691 0.94 MEN1 (0.49) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL16158802 0.94 MEN1 (0.49) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL27291179 0.93 MEN1 (0.45) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL27291073 0.92 MEN1 (0.47) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL16158689 0.92 MEN1 (0.41) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL27291055 0.90 MEN1 (0.49) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL16158744 0.89 KMT2A (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL16158715 0.89 KMT2A (0.40) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL16158681 0.88 MEN1 (0.44) MEN1KMT2AMAPTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2873666-B1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT CONTAINING SAME LG CHEMICAL LTD (KR) 2017-09-20 EP disclosed
US-9412954-B2 Heterocyclic compound and organic electronic element containing same LG CHEM, LTD. (KR) 2016-08-09 US disclosed
US-9412954-B2 Heterocyclic compound and organic electronic element containing same LG CHEM, LTD. (KR) 2016-08-09 US disclosed
EP-2873666-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT CONTAINING SAME LG Chem, Ltd. (KR) 2015-05-20 EP disclosed
US-20140299192-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT CONTAINING SAME LG CHEM, LTD. (KR) 2014-10-09 US disclosed
US-20140299192-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT CONTAINING SAME LG CHEM, LTD. (KR) 2014-10-09 US disclosed