SCHEMBL15907498

SCHEMBL15907498

Brc1ccc(-c2ccc(I)cn2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.49
RAB9A P51151 6/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
NFKB1 P19838 2/20 0.49
NFKB2 Q00653 2/20 0.49
RELA Q04206 2/20 0.49
MAPK1 P28482 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
METAP2 P50579 2/20 0.42
TP53 P04637 2/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
MAPT P10636 3/20 0.38
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37

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
SCHEMBL28577194 0.88 NPC1 (0.45) NPC1RAB9ASMN1; SMN2NFKB1NFKB2
SCHEMBL31243288 0.88 NPC1 (0.45) NPC1RAB9ASMN1; SMN2NFKB1NFKB2
SCHEMBL1416706 0.82 NPC1 (0.55) NPC1RAB9ASMN1; SMN2NFKB1NFKB2
SCHEMBL15854458 0.80 NPC1 (0.53) NPC1RAB9ASMN1; SMN2NFKB1NFKB2
SCHEMBL19933574 0.80 NPC1 (0.52) NPC1RAB9ASMN1; SMN2NFKB1NFKB2
SCHEMBL23504950 0.79 CYP11B1 (0.43) NPC1RAB9ASMN1; SMN2METAP2TP53
SCHEMBL20098748 0.79 KDM1A (0.49) NPC1RAB9ASMN1; SMN2NFKB1NFKB2
SCHEMBL20862075 0.79 NPC1 (0.53) NPC1RAB9AMAPK1L3MBTL1METAP2
SCHEMBL23632228 0.79 KDM1A (0.49) NPC1RAB9ASMN1; SMN2NFKB1NFKB2
SCHEMBL19992669 0.79 KDM1A (0.49) NPC1RAB9ASMN1; SMN2L3MBTL1METAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109942541-B Fluorenocarbazole derivative and preparation method and application thereof 武汉尚赛光电科技有限公司 2021-06-01 CN disclosed
US-9876176-B2 Aryl amine condensed cyclic compound comprising pyrene moieties and organic light-emitting diode (OLED) including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-01-23 US disclosed
US-9773987-B2 Silicon-based compound and organic light-emitting diode comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-09-26 US disclosed
US-9773987-B2 Silicon-based compound and organic light-emitting diode comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-09-26 US disclosed
US-20140353617-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-12-04 US disclosed
US-20140209869-A1 SILICON-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING THE SAME SAMSUNG DISPLAY CO., LTD (KR) 2014-07-31 US disclosed
US-20140209869-A1 SILICON-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING THE SAME SAMSUNG DISPLAY CO., LTD (KR) 2014-07-31 US disclosed