SCHEMBL1040171

SCHEMBL1040171

OCCCCNCc1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.76
CHRM2 P08172 1/20 0.73
SIGMAR1 Q99720 4/20 0.68
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
TDP1 Q9NUW8 1/20 0.64
HDAC3 O15379 2/20 0.59
HDAC1 Q13547 2/20 0.59
HDAC2 Q92769 2/20 0.59
HDAC8 Q9BY41 2/20 0.59
NCOR2 Q9Y618 2/20 0.59
MPO P05164 1/20 0.56
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.53
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C19 P33261 1/20 0.52

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
SCHEMBL7982481 0.98 MAOA (0.80) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL7984635 0.98 MAOA (0.80) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL8911797 0.98 MAOA (0.80) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL8034858 0.96 CHRM2 (0.81) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL7986745 0.96 CHRM2 (0.81) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL8030792 0.96 CHRM2 (0.81) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL8029033 0.94 CHRM2 (0.78) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL8032640 0.94 CHRM2 (0.78) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL8029046 0.94 CHRM2 (0.77) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL304695 0.94 MAOA (0.72) MAOACHRM2SIGMAR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119978177-A Raw material composition of solid titanium catalyst component, catalyst, preparation method and application thereof 中国石油化工股份有限公司 2025-05-13 CN claimed
EP-0119463-B1 PROCESS FOR THE SEPARATION OF ISOMERS OF SUBSTITUTED CYCLOPROPANECARBOXYLIC ACIDS CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1987-09-23 EP claimed
CN-119978177-A Raw material composition of solid titanium catalyst component, catalyst, preparation method and application thereof 中国石油化工股份有限公司 2025-05-13 CN disclosed
CN-113042217-B Preparation of odorless amido dithiocarbonate compound and application of odorless amido dithiocarbonate compound in flotation 中南大学 2021-11-30 CN disclosed
CN-113042217-A Preparation of odorless amido dithiocarbonate compound and application of odorless amido dithiocarbonate compound in flotation 中南大学 2021-06-29 CN disclosed
CN-106398581-A Antistatic agent for adhesive 第工业制药株式会社 2017-02-15 CN disclosed
WO-2016119707-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITIONS AND METHODS HUTCHISON MEDIPHARMA LIMITED (CN) 2016-08-04 WO disclosed
CN-103890088-B Resin composition AJINOMOTO CO.,INC. (JP) 2016-05-18 CN disclosed
US-8853224-B2 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases INDUSTRIAL RESEARCH LIMITED (NZ) 2014-10-07 US disclosed
US-8853224-B2 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases INDUSTRIAL RESEARCH LIMITED (NZ) 2014-10-07 US disclosed
CN-103890088-A Resin composition AJINOMOTO KK 2014-06-25 CN disclosed
EP-0399519-A2 Potentiating cell-mediated immunity utilizing polyamine derivatives MERRELL PHARMACEUTICALS INC. (US) 1990-11-28 EP disclosed
EP-0277635-A2 Novel polyamine derivatives MERRELL DOW PHARMACEUTICALS INC. (US) 1988-08-10 EP disclosed
US-4728646-A ANTITHROMBOTICS DR. KARL THOMAE GMBH (DE) 1988-03-01 US disclosed
US-4690923-A ANTITHROMBOTICS KARL THOMAE GMBH (DE) 1987-09-01 US disclosed
US-4518596-A Antithrombotic use of 2-(perhydro-1,4-diazino)-pyrimido (5,4,D)-pyrimidines DR. KARL THOMAE GMBH (DE) 1985-05-21 US disclosed
EP-0006206-B1 MELAMINE GROUP-CONTAINING ACRYLATES AND/OR METHACRYLATES, POLYMERIZABLE AND CURABLE COMPOSITION THEREOF, MOLDED ARTICLE MADE OF THE POLYMERIZED AND CURED COMPOSITION AND RESIN MOLDED ARTICLE COATED WITH THE COMPOSITION TEIJIN LIMITED (JP) 1982-11-24 EP disclosed
EP-0034480-A2 Alkylation of amines Grigg, Ronald Ernest (GB) 1981-08-26 EP disclosed
US-4266053-A WEAR RESISTANT POLYMER PREPARED FROM TEIJIN LIMITED (JP) 1981-05-05 US disclosed
EP-0006206-A1 Melamine group-containing acrylates and/or methacrylates, polymerizable and curable composition thereof, molded article made of the polymerized and cured composition and resin molded article coated with the composition TEIJIN LIMITED (JP) 1980-01-09 EP disclosed