SCHEMBL677162

SCHEMBL677162

CCCOC(=O)NCC#CI

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.46
KDM4E B2RXH2 1/20 0.38
GLA P06280 1/20 0.38
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA4 P43681 1/20 0.37
EPHX1 P07099 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL337339 0.89 ACHE (0.53) ACHEEPHX1ALDH1A1
SCHEMBL6688659 0.87 ACHE (0.56) ACHEEPHX1SMN1; SMN2
SCHEMBL677758 0.86 ACHE (0.59) ACHEEPHX1SMN1; SMN2
SCHEMBL28614701 0.85 ACHE (0.50) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL9676610 0.84 ACHE (0.48) ACHEKDM4EGLACHRNB2CHRNB4
SCHEMBL29132933 0.84 GAA (0.41) ACHEGLAALDH1A1SMN1; SMN2
SCHEMBL5606456 0.84 ACHE (0.50) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL28595382 0.83 ACHE (0.36) ACHECHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL6539526 0.78 ACHE (0.50) ACHEKDM4EGLACHRNB2CHRNB4
SCHEMBL29132868 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117304083-A Mildew-proof polythioether, preparation method thereof and mildew-proof sealant 北京航空材料研究院股份有限公司 2023-12-29 CN claimed
CN-106163282-A biocide 朗盛德国有限责任公司 2016-11-23 CN claimed
CN-104023529-B Use nitrogen polymer Stable Iodine compound 朗盛德国有限责任公司 2016-10-12 CN claimed
CN-104220505-B Fungicide formulations for plasticized PVC LANXESS DEUTSCHLAND GMBH (DE) 2016-06-01 CN claimed
CN-102378577-B Stabilization of iodine-containing compounds LANXESS DEUTSCHLAND GMBH (DE) 2015-10-07 CN claimed
EP-2282637-B1 ANTISAPSTAIN COMPOSITIONS COMPRISING A HALOALKYNYL COMPOUND, AN AZOLE AND AN UNSATURATED ACID ARCH TIMBER PROTECTION LTD (GB) 2015-06-17 EP claimed
CN-102497776-B Inorganic carrier materials containing nitrogen LANXESS DEUTSCHLAND GMBH 2015-02-11 CN claimed
CN-104220505-A Fungicide formulations for plasticized pvc LANXESS DEUTSCHLAND GMBH 2014-12-17 CN claimed
CN-104023529-A STABILIZATION OF COMPOUNDS CONTAINING IODINE HAVING POLYMERS COMPRISING NITROGEN LANXESS DEUTSCHLAND GMBH 2014-09-03 CN claimed
US-8664250-B1 Synergistic combination of fungicides to protect wood and wood-based products and wood treated by such combination as well as methods of making the same KOP-COAT, INC. (US) 2014-03-04 US claimed
US-5916930-A Stabilization of biocidal activity in air drying alkyds TROY CORPORATION (US) 1999-06-29 US claimed
WO-1998022543-A1 STABILIZATION OF BIOCIDAL ACTIVITY IN AIR DRYING ALKYDS TROY CORPORATION (US) 1998-05-28 WO claimed
WO-1998018756-A1 AQUEOUS SYNTHESIS OF IODOPROPARGYL CARBAMATE TROY CORPORATION (US) 1998-05-07 WO claimed
EP-0831706-A1 METHOD OF STABILIZING BIOCIDAL COMPOSITIONS OF HALOALKYNYL COMPOUNDS TROY CHEMICAL CORPORATION (US) 1998-04-01 EP claimed
US-5693849-A Aqueous synthesis of iodopropargyl carbamate TROY CORPORATION (US) 1997-12-02 US claimed
WO-1996039836-A1 METHOD OF STABILIZING BIOCIDAL COMPOSITIONS OF HALOALKYNYL COMPOUNDS TROY CHEMICAL COMPANY (US) 1996-12-19 WO claimed
EP-0438857-B1 Biocidal compositions TROY CHEMICAL CORP (US) 1994-05-04 EP claimed
US-5190580-A Antifouling marine paint TROY CHEMICAL CORPORATION (US) 1993-03-02 US claimed
US-5071479-A Synergistic mixture of iodoalkyk carbamate and tributyltin compound; marine antifouling agent TROY CHEMICAL CORPORATION (US) 1991-12-10 US claimed
EP-0438857-A1 Biocidal compositions TROY CHEMICAL CORPORATION (US) 1991-07-31 EP claimed