SCHEMBL19913112

SCHEMBL19913112

Cc1cc(C)cc(-c2ccc3c(c2)c2ccccc2n3-c2cc(-c3ccncc3)c(-n3c4ccccc4c4cc(-c5ccc(C)cc5C)ccc43)cc2C#N)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MAPT P10636 1/20 0.33
RECQL P46063 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MAPK14 Q16539 3/20 0.32
AAK1 Q2M2I8 4/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
CHEK1 O14757 1/20 0.32
GSK3B P49841 1/20 0.32
MKNK1 Q9BUB5 1/20 0.32
BMP2K Q9NSY1 1/20 0.32
XDH P47989 1/20 0.32

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
SCHEMBL22019653 0.95 KDM4E (0.35) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL22021194 0.93 MAPK14 (0.36) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL19913110 0.92 MEN1 (0.38) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL22170307 0.90 XDH (0.36) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL19913124 0.90 ALDH1A1 (0.35) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL20923155 0.89 NPSR1 (0.36) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL20923596 0.89 ALDH1A1 (0.38) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL19909012 0.89 PDE3B (0.38) KDM4ELMNANPC1RAB9AMAPT
SCHEMBL19913131 0.88 SQOR (0.35) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL19913106 0.88 MAPK14 (0.39) KDM4EMEN1KMT2AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed