SCHEMBL5828458

SCHEMBL5828458

CN(C)Sc1ccccc1C(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 2/20 0.50
GAA P10253 2/20 0.47
MAPT P10636 2/20 0.47
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
HPGD P15428 1/20 0.46
ALDH1A1 P00352 3/20 0.45
KMT2A Q03164 1/20 0.42
ELANE P08246 1/20 0.41
POLB P06746 2/20 0.41
ATM Q13315 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CDC25B P30305 1/20 0.41
TSHR P16473 2/20 0.40
HSP90AA1 P07900 1/20 0.40

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
SCHEMBL6885220 0.87 AKR1C3 (0.44) AKR1C3GAAMAPTRAB9ANPC1
SCHEMBL16534342 0.83 POLB (0.61) MAPTRAB9ANPC1HPGDALDH1A1
SCHEMBL8578095 0.79 AKR1C3 (0.55) AKR1C3GAAMAPTRAB9AHPGD
SCHEMBL9575469 0.79 AKR1C3 (0.47) AKR1C3GAAMAPTRAB9ANPC1
SCHEMBL9625706 0.79 AKR1C3 (0.59) AKR1C3GAAMAPTRAB9AALDH1A1
SCHEMBL8376800 0.79 POLB (0.65) AKR1C3GAAMAPTRAB9AALDH1A1
SCHEMBL28826038 0.77 MAPT (0.59) AKR1C3GAAMAPTRAB9AALDH1A1
SCHEMBL28423660 0.75 RAB9A (0.51) AKR1C3GAAMAPTRAB9ANPC1
SCHEMBL28380710 0.75 AKR1C3 (0.50) AKR1C3GAAMAPTRAB9AHPGD
SCHEMBL10585003 0.75 AKR1C3 (0.50) AKR1C3GAAMAPTHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116905212-A Aramid fiber oiling agent with surface modification function, preparation method thereof and surface treatment method 哈尔滨工业大学 2023-10-20 CN claimed
CN-115779157-A Reactive biomedical coating and preparation method thereof 国科温州研究院(温州生物材料与工程研究所) 2023-03-14 CN claimed
EP-0745154-B1 MULTICOMPONENT SYSTEM FOR MODIFYING, DECOMPOSING OR BLEACHING LIGNIN, LIGNIN-CONTAINING MATERIALS OR SIMILAR SUBSTANCES AND METHOD OF USING THIS SYSTEM LIGNOZYM GMBH (DE) 1998-09-16 EP claimed
CN-116905212-A Aramid fiber oiling agent with surface modification function, preparation method thereof and surface treatment method 哈尔滨工业大学 2023-10-20 CN disclosed
CN-116348440-A Process for producing 2- (halomethyl) naphthalene and 2-naphthylacetonitrile 株式会社API 2023-06-27 CN disclosed
CN-115779157-A Reactive biomedical coating and preparation method thereof 国科温州研究院(温州生物材料与工程研究所) 2023-03-14 CN disclosed
WO-2022045304-A1 METHOD FOR PRODUCING 2-(HALOGENATED METHYL)NAPHTHALENE AND 2-NAPHTHYL ACETONITRILE 株式会社エーピーアイ コーポレーション 2022-03-03 WO disclosed
CN-107532229-B Process for leaching metal sulphides with an agent having a thiocarbonyl function 不列颠哥伦比亚大学 2021-10-08 CN disclosed
CN-111850294-A Process for leaching metal sulphides with an agent having a thiocarbonyl function 不列颠哥伦比亚大学 2020-10-30 CN disclosed
CN-110072936-A Curable polymer latex composition for rubber product manufacture 昕特玛私人有限公司 2019-07-30 CN disclosed
CN-107532229-A Process for leaching metal sulphides with an agent having a thiocarbonyl function 不列颠哥伦比亚大学 2018-01-02 CN disclosed
US-5002885-A Detectable molecules, method preparation and use ENZO BIOCHEM, INC. (US) 1991-03-26 US disclosed
US-4952685-A CARRYING A METAL COMPLEXING OR BIOTIN DETECTABLE GROUPS; NUCLEOTIDES ENZO BIOCHEM, INC. (US) 1990-08-28 US disclosed
US-4943523-A METAL CHELATING GROUPS OR BIOTIN ATTACHED TO POLYSACCHARIDES, POLYPEPTIDES, POLYNUCLEOTIDES OR SYNTHETIC POLYMERS; IMMUNOASSAY IMAGING ENZO BIOCHEM, INC. (US) 1990-07-24 US disclosed
EP-0329198-A2 Ribose- and 2-deoxyribose compounds YALE UNIVERSITY (US) 1989-08-23 EP disclosed
US-4849208-A Detectable molecules, method of preparation and use ENZO BIOCHEM, INC. (US) 1989-07-18 US disclosed
US-4849505-A Detectable molecules, method of preparation and use ENZO BIOCHEM, INC. (US) 1989-07-18 US disclosed
US-4843122-A COUPLING AGENT BETWEEN BIOPOLYMER AND CHELATE AGENT OR BIOTIN ENZO BIOCHEM, INC. (US) 1989-06-27 US disclosed
EP-0154788-A2 Detectable molecules, method of preparation and use ENZO BIOCHEM, INC. (US) 1985-09-18 EP disclosed
EP-0063879-A2 Modified nucleotides and methods of preparing and using same YALE UNIVERSITY (US) 1982-11-03 EP disclosed