SCHEMBL1657802

SCHEMBL1657802

CC(O)C#Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.50
HTR2A P28223 1/20 0.45
LMNA P02545 3/20 0.44
FFAR1 O14842 1/20 0.43
GABRP O00591 1/20 0.42
GABRD O14764 1/20 0.42
GABRA1 P14867 1/20 0.42
GABRB1 P18505 1/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42
GABRA2 P47869 1/20 0.42
GABRB2 P47870 1/20 0.42
GABRA4 P48169 1/20 0.42
GABRE P78334 1/20 0.42
GABRA6 Q16445 1/20 0.42
GABRG1 Q8N1C3 1/20 0.42
GABRG3 Q99928 1/20 0.42
GABRQ Q9UN88 1/20 0.42

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
SCHEMBL2311776 1.00 APP (0.50) APPHTR2ALMNAFFAR1GABRP
SCHEMBL1657799 1.00 APP (0.50) APPHTR2ALMNAFFAR1GABRP
SCHEMBL12096984 0.87 KMT2A (0.41) APPHTR2ALMNAFFAR1GABRP
SCHEMBL9349149 0.82 ACACB (0.57) LMNAFFAR1ACACB
SCHEMBL617501 0.82 APP (0.46) APPHTR2ALMNAFFAR1NPSR1
SCHEMBL18105076 0.80 APP (0.55) APPHTR2ALMNAFFAR1NPSR1
SCHEMBL19062293 0.80 APP (0.55) APPHTR2ALMNAFFAR1NPSR1
SCHEMBL3031415 0.80 APP (0.55) APPHTR2ALMNAFFAR1NPSR1
SCHEMBL5604749 0.79 APP (0.47) APPLMNAGABRPGABRDGABRA1
SCHEMBL28722213 0.79 GABRP (0.45) FFAR1GABRPGABRDGABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119684964-A Self-adhesive high-heat-conductivity self-leveling flame-retardant organic silicon pouring sealant and preparation method thereof 中蓝晨光化工研究设计院有限公司 2025-03-25 CN claimed
CN-117466790-B Preparation method of alpha-sulfinylated carbonyl compound 西北师范大学 2024-05-28 CN claimed
CN-117466790-A Preparation method of alpha-sulfinylated carbonyl compound 西北师范大学 2024-01-30 CN claimed
CN-114921220-A Pressure-sensitive adhesive and protective film suitable for polylactic acid resin base material and preparation method thereof 惠州市浩明科技股份有限公司 2022-08-19 CN claimed
EP-2142552-B1 INHIBITORS OF DIACYLGLYCEROL O-ACYLTRANSFERASE TYPE 1 ENZYME ABBOTT LAB (US) 2012-08-01 EP claimed
US-4081468-A HERBICIDES STAUFFER CHEMICAL COMPANY (US) 1978-03-28 US claimed
CN-119684964-A Self-adhesive high-heat-conductivity self-leveling flame-retardant organic silicon pouring sealant and preparation method thereof 中蓝晨光化工研究设计院有限公司 2025-03-25 CN disclosed
CN-117466790-B Preparation method of alpha-sulfinylated carbonyl compound 西北师范大学 2024-05-28 CN disclosed
CN-114409501-B Method for preparing propargyl alcohol compound by taking pinacol borane as hydrogen source 云南民族大学 2024-05-10 CN disclosed
CN-117466790-A Preparation method of alpha-sulfinylated carbonyl compound 西北师范大学 2024-01-30 CN disclosed
US-11814462-B2 Functionalized cyclic polymers and methods of preparing same UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2023-11-14 US disclosed
WO-2023190354-A1 LAMINATED PLASTIC FILM, USE OF LAMINATED PLASTIC FILM AS RECYCLABLE RAW MATERIAL, LAMINATED PLASTIC FILM FOR RECYCLABLE RAW MATERIAL, AND METHOD FOR PRODUCING RECYCLABLE PLASTIC FILM 三菱ケミカル株式会社 2023-10-05 WO disclosed
WO-2023276648-A1 LIQUID COMPOSITION FOR SILICONE RUBBER SPHERICAL PARTICLES, SILICONE RUBBER SPHERICAL PARTICLES AND PRODUCTION METHOD THEREFOR, AND SILICONE COMPOSITE PARTICLES AND PRODUCTION METHOD THEREFOR 信越化学工業株式会社 2023-01-05 WO disclosed
US-6448443-B1 GENERATED FROM DIVERSIFIABLE SCAFFOLDS SYNTHESIZED FROM THE PYRIDINE-BASED TEMPLATE ISONICOTINAMIDE; ALSO PROVIDES A NOVEL ORTHO-NITROBENZYL PHOTOLINKER; SYNTHESIZED FROM A SHIKIMIC ACID BASED EPOXYOL TEMPLATE PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2002-09-10 US disclosed
US-5750806-A Preparation of alkenes by partial hydrogenation of alkynes over fixed-bed palladium catalysts BASF AKTIENGESELLSCHAFT (DE) 1998-05-12 US disclosed
US-5312950-A Method for purification of alcohols EASTMAN KODAK COMPANY (US) 1994-05-17 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