SCHEMBL677758

SCHEMBL677758

CCCCCCOC(=O)NCC#CI

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACHE P22303 13/20 0.59
EPHX1 P07099 1/20 0.56
EPHX2 P34913 2/20 0.46
NAAA Q02083 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL6688659 0.98 ACHE (0.56) ACHEEPHX1EPHX2NPC1RAB9A
SCHEMBL337339 0.93 ACHE (0.53) ACHEEPHX1
SCHEMBL677162 0.86 ACHE (0.46) ACHEEPHX1SMN1; SMN2
SCHEMBL11810518 0.81 ACHE (0.65) ACHEEPHX1NAAANPC1RAB9A
SCHEMBL6971630 0.81 ACHE (0.65) ACHEEPHX1NAAANPC1RAB9A
Glycinebetaine SCHEMBL5606652 0.80 ACHE (0.41) ACHEEPHX1
SCHEMBL19506292 0.79 ACHE (0.62) ACHEEPHX1EPHX2NAAANPC1
SCHEMBL9353452 0.79 ACHE (0.46) ACHEEPHX1NAAA
SCHEMBL8769630 0.79 ACHE (0.56) ACHEEPHX1
SCHEMBL6958951 0.79 ACHE (0.61) ACHEEPHX1NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-8435643-B2 Antisapstain compositions comprising a haloalkynl compound, an azole and an unsaturated acid ARCH TIMBER PROTECTION LIMITED (GB) 2013-05-07 US claimed
EP-1599095-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) 2012-08-15 EP claimed
CN-102497776-A Inorganic carrier materials containing nitrogen LANXESS DEUTSCHLAND GMBH 2012-06-13 CN claimed
CN-102471526-A Polymers comprising heterocyclic 3-membered ring compounds and iodine-containing compounds LANXESS DEUTSCHLAND GMBH 2012-05-23 CN 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
EP-0370665-B1 Wood preservative and soil treatment composition TROY CHEMICAL CORP (US) 1994-03-30 EP 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
EP-0370665-A2 Wood preservative and soil treatment composition TROY CHEMICAL CORPORATION (US) 1990-05-30 EP claimed