SCHEMBL9509522

SCHEMBL9509522

NCc1ccc2c(c1)C(=O)c1ccccc1C2=O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.66
RAB9A P51151 6/20 0.66
SMN1; SMN2 Q16637 5/20 0.66
MAPK1 P28482 5/20 0.66
ALDH1A1 P00352 4/20 0.66
LMNA P02545 4/20 0.66
L3MBTL1 Q9Y468 2/20 0.66
MAPT P10636 2/20 0.66
TP53 P04637 1/20 0.55
CYP3A4 P08684 1/20 0.55
TSHR P16473 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
ELANE P08246 1/20 0.50
CDC25B P30305 1/20 0.50
CSNK2A1 P68400 3/20 0.49
CSNK2A2 P19784 1/20 0.49
CSNK2B P67870 1/20 0.49
CSNK2A3 Q8NEV1 1/20 0.49

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
SCHEMBL21573719 0.94 NPC1 (0.55) NPC1RAB9ASMN1; SMN2MAPK1ALDH1A1
SCHEMBL28313235 0.91 NPC1 (0.72) NPC1RAB9ASMN1; SMN2MAPK1ALDH1A1
SCHEMBL11251526 0.84 SMN1; SMN2 (0.61) NPC1RAB9ASMN1; SMN2MAPK1ALDH1A1
SCHEMBL9209968 0.81 NPC1 (0.68) NPC1RAB9ASMN1; SMN2MAPK1ALDH1A1
SCHEMBL4371665 0.80 AKR1B1 (0.51) NPC1RAB9ASMN1; SMN2MAPK1ALDH1A1
SCHEMBL36840 0.79 NPC1 (1.00) NPC1RAB9ASMN1; SMN2MAPK1ALDH1A1
SCHEMBL707684 0.79 NPC1 (0.66) NPC1RAB9ASMN1; SMN2MAPK1ALDH1A1
Anthraquinone SCHEMBL6310187 0.79 NPC1 (1.00) NPC1RAB9ASMN1; SMN2MAPK1ALDH1A1
SCHEMBL12807506 0.79 NPC1 (0.66) NPC1RAB9ASMN1; SMN2MAPK1ALDH1A1
SCHEMBL9240147 0.79 NPC1 (0.66) NPC1RAB9ASMN1; SMN2MAPK1ALDH1A1

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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110128571-B Preparation method and application of modified polystyrene resin 厦门理工学院 2021-09-24 CN claimed
CN-109748810-B 2-aminomethyl-9, 10-anthraquinone derivative, preparation method and application thereof 上海医药工业研究院 2021-09-03 CN claimed
CN-110204056-A The preparation method and application of anthraquinone compounds modified hydrophilic carrier 厦门理工学院 2019-09-06 CN claimed
CN-110157031-A The preparation method and application of frosting grafting anthraquinone compounds 厦门理工学院 2019-08-23 CN claimed
CN-110105586-A Surface grafting graphene/plastics of anthraquinone compounds composite material, preparation method and application 厦门理工学院 2019-08-09 CN claimed
CN-110092389-A A kind of tourmaline of surface grafting anthraquinone compounds, preparation method and application 厦门理工学院 2019-08-06 CN claimed
CN-107442080-A A kind of sorbing material and preparation method thereof 徐州工程学院 2017-12-08 CN claimed
CN-106866018-A A kind of air entrained concrete activity excitant and preparation method thereof 徐州工程学院 2017-06-20 CN claimed
CN-106172492-A A kind of rare cultural relics, literature and history archives, calligraphy and painting protecting agent preparation method and applications 徐州工程学院 2016-12-07 CN claimed
CN-104841497-A Method for preparing oxidization reduction medium carrier by chemically grafting anthraquinone through ion exchange resin UNIV HEBEI SCIENCE & TECH 2015-08-19 CN claimed
CN-1313434-C Darr reaction process of quinone derivative composition to produce free radical and its application SHANDONG PROVINCIAL RES CT FOR (CN) 2007-05-02 CN claimed
CN-1526695-A Darr reaction process of quinone derivative composition to produce free radical and its application 山东省生物信息工程技术研究中心 2004-09-08 CN claimed
CN-114689755-B Pretreatment method for detecting tobacco aroma substances with ultralow concentration 湖北中烟工业有限责任公司 2024-02-27 CN disclosed
CN-114689755-A Pretreatment method for detecting ultralow-concentration tobacco flavor substances 湖北中烟工业有限责任公司 2022-07-01 CN disclosed
CN-110128571-B Preparation method and application of modified polystyrene resin 厦门理工学院 2021-09-24 CN disclosed
CN-109748810-B 2-aminomethyl-9, 10-anthraquinone derivative, preparation method and application thereof 上海医药工业研究院 2021-09-03 CN disclosed
US-4849533-A MONO-OR DIGLYCIDYL ANTHRAQUINONES, REDOX CATALYSTS FOR METAL ELECTRODEPOSITION CIBA-GEIGY CORPORATION (US) 1989-07-18 US disclosed
EP-0112798-B1 LIGHT-SENSITIVE AND POSSIBLY CROSS-LINKABLE MIXTURE OF COMPOUNDS APT TO CONDENSATION AND ADDITION REACTIONS, REACTION PRODUCTS OBTAINED THEREBY AND USE THEREOF CIBA-GEIGY AG (CH) 1987-05-13 EP disclosed
US-4657842-A Photosensitive compositions of matter comprising epoxide compounds and functional anthraquinones CIBA-GEIGY CORPORATION (US) 1987-04-14 US disclosed
EP-0112798-A1 Light-sensitive and possibly cross-linkable mixture of compounds apt to condensation and addition reactions, reaction products obtained thereby and use thereof CIBA-GEIGY AG (CH) 1984-07-04 EP disclosed