SCHEMBL19909055

SCHEMBL19909055

Cc1ccc(-c2ccc3c4ccccc4n(-c4cc(-c5ccncc5)cc(-n5c6ccccc6c6ccc(-c7ccc(C)cc7C)cc65)c4C#N)c3c2)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.36
SQOR Q9Y6N5 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
PDE9A O76083 1/20 0.34
PDE1C Q14123 1/20 0.34
LMNA P02545 2/20 0.33
TP53 P04637 1/20 0.33
HIF1A Q16665 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
FLT3 P36888 2/20 0.33
PIK3R2 O00459 1/20 0.33
CYP11B2 P19099 1/20 0.33
CHRM1 P11229 1/20 0.33
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 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
SCHEMBL19909057 0.95 ABL1 (0.39) ABL1SQORTDP1MEN1KMT2A
SCHEMBL19919788 0.94 ABL1 (0.33) ABL1SQORTDP1MEN1KMT2A
SCHEMBL19909063 0.94 SQOR (0.34) ABL1SQORTDP1MEN1KMT2A
SCHEMBL19909421 0.91 ABL1 (0.38) ABL1SQORTDP1LMNATP53
SCHEMBL19913187 0.90 PDE9A (0.39) SQORTDP1PDE9APDE1CLMNA
SCHEMBL19909152 0.90 CYP11B2 (0.38) SQORTDP1MEN1KMT2APDE9A
SCHEMBL20619434 0.89 CYP11B2 (0.44) ABL1SQORTDP1NPC1RAB9A
SCHEMBL19913193 0.89 S1PR1 (0.34) ABL1
SCHEMBL19909221 0.89 PDE9A (0.34) ABL1TDP1NPC1PDE9APDE1C
SCHEMBL19913185 0.89 MEN1 (0.37) ABL1SQORTDP1MEN1KMT2A

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
EP-3287451-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-28 EP disclosed