SCHEMBL309218

SCHEMBL309218

CCCCN(CC#CI)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.42
CA1 P00915 3/20 0.42
CA9 Q16790 3/20 0.42
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP3 P08254 1/20 0.40
MMP8 P22894 1/20 0.40
ZDHHC20 Q5W0Z9 2/20 0.36
ZDHHC2 Q9UIJ5 1/20 0.35
ALDH1A1 P00352 1/20 0.34
ALDH2 P05091 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
LTB4R2 Q9NPC1 2/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
CA2 P00918 1/20 0.32
PTPN7 P35236 3/20 0.32
HMGCR P04035 1/20 0.32
HDAC3 O15379 1/20 0.31

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
SCHEMBL1022096 0.93 ZDHHC20 (0.44) CA12CA1CA9ZDHHC20ZDHHC2
SCHEMBL4611964 0.89 TSHR (0.41) CA12CA1CA9ALDH1A1HPGD
SCHEMBL5968730 0.87 CA12 (0.33) CA12CA1CA9MMP1MMP2
SCHEMBL7629481 0.87 CA12 (0.33) CA12CA1CA9MMP1MMP2
SCHEMBL5968728 0.84 CA12 (0.32) CA12CA1CA9MMP1MMP2
SCHEMBL3686530 0.84 CA12 (0.41) CA12CA1CA9MMP1MMP2
SCHEMBL29033807 0.81 CA12 (0.39) CA12CA1CA9MMP1MMP2
SCHEMBL8961036 0.80 CA12 (0.38) CA12CA1CA9MMP1MMP2
SCHEMBL28107393 0.80 CA12 (0.38) CA12CA1CA9MMP1MMP2
SCHEMBL28037512 0.80 CA12 (0.38) CA12CA1CA9MMP1MMP2

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

Appears in 2503 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260146779-A1 COMPOSTABLE COLD PACK COMPRISING AN ABSORBANT SUBSTRATE LOADED WITH WATER MICROTEK HOLDINGS, INC. (US) 2026-05-28 US claimed
CN-117701328-B Water-soluble punching shear oil and preparation method thereof DONGGUAN PACOIL LUBRICANT Co.,Ltd. (CN) 2026-05-26 CN claimed
US-12522736-B2 Biocidal aerogel compositions for surface protection AEROGEL APS (DK) 2026-01-13 US claimed
EP-4176721-B1 BIOCIDAL POLYMER BLENDS LANXESS DEUTSCHLAND GMBH (DE) 2026-01-07 EP claimed
US-12486408-B2 Use of biocidal aerogel compositions in on-shore paints, coatings and sealants AEROGEL APS (DK) 2025-12-02 US claimed
EP-4081030-B1 BIOCIDAL AEROGEL COMPOSITIONS FOR SURFACE PROTECTION AEROGEL APS (DK) 2025-11-26 EP claimed
EP-4081031-B1 USE OF BIOCIDAL AEROGEL COMPOSITIONS IN PAINTS AND SEALANTS EXPOSED TO HUMIDITY AND WATER AEROGEL APS (DK) 2025-11-26 EP claimed
US-12398222-B2 Flame-retardant antimicrobial agent, preparation method therefor and use thereof, and flame-retardant antimicrobial thermoplastic resin composition CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2025-08-26 US claimed
EP-3986371-B1 PRODUCT FOR DYEING KERATINOUS MATERIAL, CONTAINING AMINOSILICONE, A CHROMOPHORIC COMPOUND, PRESERVATIVE AND ETHOXYLATED FATTY ALCOHOL HENKEL AG & CO KGAA (DE) 2025-08-20 EP claimed
US-20250234861-A1 LACTONES FOR ENHANCING THE ACTIVITY OF ANTIMICROBIAL AGENTS BASF SE (DE) 2025-07-24 US claimed
US-5200421-A Synergistic combination of azole fungicide tebuconazole and 3-iodo-2-propargyl N-butylcarbamate BAYER AKTIENGESELLSCHAFT (DE) 1993-04-06 US claimed
US-5190944-A Bactericides or fungicides ROHM AND HAAS COMPANY (US) 1993-03-02 US claimed
US-5158596-A SYNERGISTIC ANTIALGAL COMPOSITIONS COMPRISING DIPHENYLETHERS AND CERTAIN COMMERCIAL BIOCIDES, METHODS OF CONTROLLING ALGAE, AND COATING COMPOSITIONS COMPRISING THE ANTIALGAL COMPOSITIONS ROHM AND HAAS COMPANY (US) 1992-10-27 US claimed
EP-0505025-A2 Antialgal compositions comprising diphenylethers and sodium hypochlorite ROHM AND HAAS COMPANY (US) 1992-09-23 EP claimed
EP-0490570-A2 Microbicidal compositions containing 4,5-dichloro-2-cyclohexyl-3-isothiazolone and 3-iodo-2-propynylbutylcarbamate ROHM AND HAAS COMPANY (US) 1992-06-17 EP claimed
EP-0454431-A1 Wood preservative composition Takeda Chemical Industries, Ltd. (JP) 1991-10-30 EP claimed
EP-0431752-A2 Synergistic microbicidal combinations ROHM AND HAAS COMPANY (US) 1991-06-12 EP claimed
EP-0266110-B1 A MICROBICIDAL PRESERVATIVE COMPOSITION BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1990-07-11 EP claimed
EP-0375367-A2 Biocidal compositions ROHM AND HAAS COMPANY (US) 1990-06-27 EP claimed
US-4915909-A ON WOOD IN INDUSTRIAL WATER SYSTEMS NALCO CHEMICAL COMPANY (US) 1990-04-10 US claimed