SCHEMBL16558476

SCHEMBL16558476

c1ccc(-c2ccc3c(-c4ccc5c6c(cccc46)-c4ccccc4S5)c4cc(-c5ccccc5)ccc4c(-c4ccc5c6c(cccc46)-c4ccccc4S5)c3c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.33
MEN1 O00255 1/20 0.33
APAF1 O14727 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
XBP1 P17861 1/20 0.33
PTBP1 P26599 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
GALK1 P51570 1/20 0.33
BLM P54132 1/20 0.33
SMAD3 P84022 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
DRD2 P14416 1/20 0.32
PIM1 P11309 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
SCHEMBL22969178 0.91 PTGER1 (0.31) THRBMEN1APAF1NPC1LMNA
SCHEMBL22969193 0.91 ACHE (0.33)
SCHEMBL22969354 0.89 PTGER1 (0.32) THRBMEN1APAF1NPC1LMNA
SCHEMBL22969342 0.89 ACHE (0.33)
SCHEMBL22969186 0.88 ACHE (0.34) THRBMAPTHTTSMN1; SMN2THRA
SCHEMBL22969171 0.88 PDCD1 (0.36) MAPTHTTSMN1; SMN2
SCHEMBL22969461 0.86 PDCD1 (0.37) MAPTRAB9ASMN1; SMN2
SCHEMBL22969353 0.86 ACHE (0.35) THRBMAPTSMN1; SMN2THRA
SCHEMBL16558558 0.86 CRHBP (0.36) MAPTHTTBLMATMSMN1; SMN2
SCHEMBL16558471 0.86 CRHBP (0.36) MAPTHTTBLMATMSMN1; SMN2

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
US-9601700-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-03-21 US disclosed
US-9601700-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-03-21 US disclosed
US-20150069344-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-12 US disclosed
US-20150069344-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-12 US disclosed