SCHEMBL487465

SCHEMBL487465

CC(C)(O)C#Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
APP P05067 1/20 0.50
ASIC3 Q9UHC3 1/20 0.46
HTT P42858 1/20 0.44
HAO1 Q9UJM8 2/20 0.41
ALDH1A1 P00352 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
LMNA P02545 1/20 0.41
PTGES2 Q9H7Z7 2/20 0.40
TSHR P16473 1/20 0.40
NPC1 O15118 1/20 0.40
MTOR P42345 1/20 0.40
RAB9A P51151 1/20 0.40
KCNH2 Q12809 1/20 0.39
TNIK Q9UKE5 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 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
SCHEMBL18561130 0.96 MAPT (0.53) MAPTAPPASIC3HTTHAO1
Dimethylamine SCHEMBL700542 0.94 MAPT (0.51) MAPTAPPASIC3HTTHAO1
Bicarbonate SCHEMBL28540490 0.94 MAPT (0.51) MAPTAPPASIC3HTTHAO1
SCHEMBL12391039 0.87 ASIC3 (0.50) MAPTASIC3HTTHAO1ALDH1A1
SCHEMBL3190454 0.85 MAPT (0.47) MAPTAPPASIC3HTTALDH1A1
SCHEMBL11443850 0.84 HAO1 (0.46) MAPTASIC3HTTHAO1L3MBTL1
SCHEMBL2601886 0.82 PTGES2 (0.52) MAPTASIC3HTTHAO1ALDH1A1
SCHEMBL9906153 0.82 MAPT (0.53) MAPTAPPNPSR1NPC1MTOR
SCHEMBL12935540 0.82 MAPT (0.53) MAPTAPPNPSR1NPC1MTOR
SCHEMBL29116864 0.81 MAPT (0.53) MAPTAPPASIC3HTTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115364903-B Preparation method of catalyst for synthesizing alpha-hydroxyketone 东南大学 2024-03-12 CN claimed
CN-115364903-A Preparation method of catalyst for synthesizing alpha-hydroxyketone 东南大学 2022-11-22 CN claimed
CN-111303096-B Synthesis method of polysubstituted 1, 3-dihydronaphtho [2,3-c ] furan derivative 海南医学院 2021-12-28 CN claimed
CN-110483570-B Process for preparing organic phosphine ligand compound with large steric hindrance and electron deficiency 中国科学技术大学 2020-12-25 CN claimed
US-7727692-B2 Electrophotographic photoreceptor, image forming apparatus, and process cartridge FUJI XEROX CO., LTD. (JP) 2010-06-01 US claimed
EP-4711424-A1 AQUEOUS INK COMPOSITION FOR WRITING UTENSILS, AND WRITING UTENSIL OBTAINED USING SAME MITSUBISHI PENCIL COMPANY, LIMITED (JP) 2026-03-18 EP disclosed
CN-119972082-A For catalyzing CO2And Cu for synthesizing cyclic carbonate by substituting alkynol2O-supported ZnAl-LDH catalyst and preparation method and application thereof 上海应用技术大学 2025-05-13 CN disclosed
CN-119972083-A For catalyzing CO2Cu for synthesizing cyclic carbonate from alkynol2O-supported ZIF-derived ZnCo catalyst and preparation method and application thereof 上海应用技术大学 2025-05-13 CN disclosed
CN-115710227-B Preparation method of indenoisoquinoline derivative 深圳万知达企业管理有限公司 2025-03-18 CN disclosed
CN-117777467-A Polyether modified polysiloxane and preparation method thereof, foam homogenizing type polyether modified polysiloxane defoamer and preparation method thereof 科之杰新材料集团有限公司 2024-03-29 CN disclosed
CN-116211925-B A veterinary composition containing flos Lonicerae and radix astragali with antioxidant and immunity enhancing effects 青岛和美生物科技有限公司 2024-03-15 CN disclosed
CN-115364903-B Preparation method of catalyst for synthesizing alpha-hydroxyketone 东南大学 2024-03-12 CN disclosed
US-20070105041-A1 Lithographic printing plate comprising bi-functional compounds AGFA-GEVAERT (BE) 2007-05-10 US disclosed
US-4428870-A Perfume composition containing phenylethynyl carbinols FRITZSCHE DODGE & OLCOTT INC. (US) 1984-01-31 US disclosed
US-4322432-A Cyclopropanecarboxylic acid alkynyl esters, processes for producing them, and their use as pesticides CIBA-GEIGY CORPORATION (US) 1982-03-30 US disclosed
US-4198414-A 4-H-PYRROLO(3,2,1-IJ)QUINOLIN-1,2-DIONES A. H. ROBINS COMPANY, INC. (US) 1980-04-15 US disclosed
US-4179561-A REACTING A 3-DIAZOOXINDOLE WITH A SUBSTITUTED ACETYLENE E. R. SQUIBB & SONS, INC. (US) 1979-12-18 US disclosed
US-4112096-A ANTIALLERGENS E. R. SQUIBB & SONS, INC. (US) 1978-09-05 US disclosed
US-4111917-A POLYURETHANES W. R. GRACE & CO. (US) 1978-09-05 US disclosed
US-4076818-A ANTIALLERGENS E. R. SQUIBB & SONS, INC. (US) 1978-02-28 US disclosed