SCHEMBL3678013

SCHEMBL3678013

CC(C)C1COC(c2ccccn2)=N1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.54
RAB9A P51151 3/20 0.54
MAPT P10636 2/20 0.54
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 5/20 0.39
LMNA P02545 3/20 0.39
CYP1A2 P05177 2/20 0.39
CCR1 P32246 2/20 0.39
CCR5 P51681 2/20 0.39
CCR8 P51685 2/20 0.39
POLB P06746 1/20 0.39
METAP1 P53582 1/20 0.39
BLM P54132 1/20 0.39
HIF1A Q16665 1/20 0.39
DOHH Q9BU89 1/20 0.39
P4HTM Q9NXG6 1/20 0.39
HTT P42858 3/20 0.39
CYP2C9 P11712 1/20 0.38

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
SCHEMBL30426579 1.00 NPC1 (0.56) NPC1SMN1; SMN2RAB9AMAPTMEN1
SCHEMBL8405877 1.00 NPC1 (0.56) NPC1SMN1; SMN2RAB9AMAPTMEN1
SCHEMBL28344271 1.00 NPC1 (0.56) NPC1SMN1; SMN2RAB9AMAPTMEN1
SCHEMBL23912877 0.85 NPC1 (0.41) NPC1SMN1; SMN2RAB9AMAPTMEN1
SCHEMBL22444733 0.85 NPC1 (0.55) NPC1SMN1; SMN2RAB9AMAPTMEN1
Hydrochloric Acid SCHEMBL7171153 0.83 NPC1 (0.62) NPC1SMN1; SMN2RAB9AMAPTMEN1
Hydrochloric Acid SCHEMBL7176406 0.83 NPC1 (0.62) NPC1SMN1; SMN2RAB9AMAPTMEN1
Hydrochloric Acid SCHEMBL7171650 0.83 NPC1 (0.62) NPC1SMN1; SMN2RAB9AMAPTMEN1
Hydrochloric Acid SCHEMBL7176410 0.83 NPC1 (0.62) NPC1SMN1; SMN2RAB9AMAPTMEN1
Hydrochloric Acid SCHEMBL7182624 0.83 NPC1 (0.62) NPC1SMN1; SMN2RAB9AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116813643-A Chiral oxo-bridged oxazolyl heterocyclic compound and preparation method thereof 北京工业大学 2023-09-29 CN claimed
CN-113880775-A Barbiturate compound and preparation method thereof 北京工业大学 2022-01-04 CN claimed
CN-106892893-B Method for preparing lactide from lactic acid oligomer 中国科学院长春应用化学研究所 2020-09-25 CN claimed
US-9663637-B2 Polymers functionalized with unsaturated heterocycles containing an azolinyl group BRIDGESTONE CORPORATION (JP) 2017-05-30 US claimed
US-20140187711-A1 POLYMERS FUNCTIONALIZED WITH UNSATURATED HETEROCYCLES CONTAINING AN AZOLINYL GROUP BRIDGESTONE CORPORATION (JP) 2014-07-03 US claimed
US-5939568-A Accelerated catalysis of olefinic epoxidations THE SCRIPPS RESEARCH INSTITUTE (US) 1999-08-17 US claimed
CN-114245809-B Polyimide resin composition, polyimide varnish and polyimide film 三菱瓦斯化学株式会社 2024-07-09 CN disclosed
CN-118056157-A Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display element 日产化学株式会社 2024-05-17 CN disclosed
CN-113166413-B Polyimide resin composition and polyimide film 三菱瓦斯化学株式会社 2024-02-09 CN disclosed
CN-117377656-A Benzospiro heterocyclic derivatives and uses thereof 南京明德新药研发有限公司 2024-01-09 CN disclosed
CN-116813643-A Chiral oxo-bridged oxazolyl heterocyclic compound and preparation method thereof 北京工业大学 2023-09-29 CN disclosed
CN-112469764-B Polyglycolic acid resin and process for producing the same 上海浦景化工技术股份有限公司 2023-09-26 CN disclosed
CN-109722259-B Liquid crystal aligning agent, method for forming liquid crystal alignment film, and method for manufacturing display element 捷恩智株式会社 2023-08-15 CN disclosed
EP-1513917-A1 USE OF TRANSITION METAL COMPLEXES WITH NITROGEN-CONTAINING POLYDENTATE LIGANDS AS A BLEACHING CATALYST AND BLEACHING AGENT COMPOSITION Degussa AG (DE) 2005-03-16 EP disclosed
CN-1582414-A Composition having permitivity being radiation-sensitively changeable and method for forming permitivity pattern JSR CORP (JP) 2005-02-16 CN disclosed
WO-2003106610-A1 USE OF TRANSITION METAL COMPLEXES WITH NITROGEN-CONTAINING POLYDENTATE LIGANDS AS A BLEACHING CATALYST AND BLEACHING AGENT COMPOSITION DEGUSSA AG (DE) 2003-12-24 WO disclosed
CN-1427306-A Radiation sensitive refractivity change composition and method for changing refractivity JSR CORP (JP) 2003-07-02 CN disclosed
CN-1388919-A Composition having refractive index sensitively changealbe by radiation and method for forming refractive index pattern JSR CORP (JP) 2003-01-01 CN disclosed
US-5939568-A Accelerated catalysis of olefinic epoxidations THE SCRIPPS RESEARCH INSTITUTE (US) 1999-08-17 US disclosed
US-5852205-A Catalytic process IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1998-12-22 US disclosed