SCHEMBL474978

SCHEMBL474978

Brc1ccc(-c2ncnc(-c3ccccc3)n2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.60
RAB9A P51151 2/20 0.60
NFKB1 P19838 1/20 0.60
NFKB2 Q00653 1/20 0.60
RELA Q04206 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
NR1H4 Q96RI1 2/20 0.56
ALDH1A1 P00352 2/20 0.56
MAPK1 P28482 2/20 0.56
NR1H2 P55055 4/20 0.53
NR1H3 Q13133 4/20 0.53
DGAT1 O75907 1/20 0.53
CYP1B1 Q16678 2/20 0.46
CYP1A1 P04798 1/20 0.46
CYP1A2 P05177 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
MAPK13 O15264 1/20 0.43
GCGR P47871 1/20 0.43

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
SCHEMBL28451522 0.98 NPC1 (0.63) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL28409729 0.98 NPC1 (0.63) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL16922581 0.87 NPC1 (0.52) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL30375151 0.87 NPC1 (0.52) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL23008279 0.87 NPC1 (0.52) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL23008430 0.87 NPC1 (0.52) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL13719392 0.87 NPC1 (0.52) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL2627622 0.87 ALDH1A1 (0.67) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL2161418 0.87 ALDH1A1 (0.67) NPC1RAB9ANFKB1NFKB2RELA
SCHEMBL56387 0.87 L3MBTL1 (0.54) NPC1RAB9ANFKB1NFKB2RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117820639-B Polyvinyl pyridinium salt compound and preparation method and application thereof 北京师范大学珠海校区 2024-06-21 CN disclosed
CN-117820639-A Polyvinyl pyridinium salt compound and preparation method and application thereof 北京师范大学珠海校区 2024-04-05 CN disclosed
CN-110054593-B Method for synthesizing 1,3, 5-triazine derivative 南京工业大学 2022-07-08 CN disclosed
CN-112939972-B Thermal activation delayed fluorescent material of chiral triptycene skeleton and preparation method and application thereof 中国科学院化学研究所 2022-06-21 CN disclosed
CN-108475735-B Organic electron transport material and organic electroluminescent element using same 大电株式会社 2021-10-22 CN disclosed
CN-109476828-B Method for producing polymer compound 住友化学株式会社 2021-08-06 CN disclosed
CN-112939972-A Thermal activation delayed fluorescent material of chiral triptycene skeleton and preparation method and application thereof 中国科学院化学研究所 2021-06-11 CN disclosed
US-11031561-B2 Organic electron transport material and organic electroluminescent element using same DYDEN CORPORATION (JP) 2021-06-08 US disclosed
CN-108475734-B Organic electron transport material and organic electroluminescent element using same 大电株式会社 2020-04-21 CN disclosed
CN-103325962-B The compound used in the opto-electronic device CDT牛津有限公司 2016-12-07 CN disclosed
EP-2166582-B1 Conjugated copolymer comprising triazine, its preparation and uses CAMBRIDGE DISPLAY TECH LTD (GB) 2012-02-01 EP disclosed
US-20110279028-A1 Polymer, Its Preparation and Uses O'DELL RICHARD (DE) 2011-11-17 US disclosed
EP-2166582-A1 Conjugated copolymer comprising triazine, its preparation and uses Cambridge Display Technology Limited (GB) 2010-03-24 EP disclosed
EP-1377627-B1 CONJUGATED HOMO- AND COPOLYMERS COMPRISING SUBSTITUTED OR UNSUBSTITUTED HETEROARYL GROUP, ITS PREPARATION AND USES CAMBRIDGE DISPLAY TECH LTD (GB) 2009-12-16 EP disclosed
EP-1377627-A2 CONJUGATED HOMO- AND COPOLYMERS COMPRISING SUBSTITUTED OR UNSUBSTITUTED HETEROARYL GROUP, ITS PREPARATION AND USES Cambridge Display Technology Limited (GB) 2004-01-07 EP disclosed
WO-2002083760-A2 CONJUGATED HOMO-AND COPOLYMERS COMPRISING SUBSTITUTED OR UNSUBSTITUTED HETEROARYL GROUP, ITS PREPARATION AND USES CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2002-10-24 WO disclosed