SCHEMBL5365372

SCHEMBL5365372

O=C(O)CC(C(=O)O)(C1CCCCC1)P(=O)(O)O

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.33
CA12 O43570 3/20 0.33
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
CA9 Q16790 3/20 0.33
MMP1 P03956 2/20 0.33
MMP3 P08254 2/20 0.33
MMP8 P22894 2/20 0.33
MMP9 P14780 1/20 0.33
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
METAP1 P53582 1/20 0.32
ALDH1A1 P00352 2/20 0.30
FDPS P14324 1/20 0.30

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
SCHEMBL10360945 0.76 FDPS (0.38) MMP2CA12CA1CA2CA9
SCHEMBL8528274 0.76 FOLH1 (0.35) METAP1FDPS
SCHEMBL2579739 0.74 ALDH1A1 (0.36) MMP2CA12CA1CA2CA9
SCHEMBL8531443 0.73 FOLH1 (0.36) METAP1FDPS
SCHEMBL20168656 0.72 KEAP1 (0.37) KEAP1NFE2L2ALDH1A1
SCHEMBL10358243 0.71 KEAP1 (0.36) KEAP1NFE2L2ALDH1A1
SCHEMBL31352036 0.70 ALDH1A1 (0.36) KEAP1NFE2L2ALDH1A1
SCHEMBL11453750 0.69 CYP2D6 (0.34) KEAP1NFE2L2ALDH1A1
SCHEMBL8131339 0.69 KEAP1 (0.37) KEAP1NFE2L2ALDH1A1
SCHEMBL29142969 0.69 KEAP1 (0.37) KEAP1NFE2L2ALDH1A1

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3263687-A1 ANTIMICROBIAL HARD SURFACE CLEANING COMPOSITION The Procter & Gamble Company (US) 2018-01-03 EP claimed
EP-3263688-A1 IMPROVED SHINE IN SOFT WATER The Procter & Gamble Company (US) 2018-01-03 EP claimed
EP-1185355-B1 ANTI-CORROSION SOLUTIONS FOR AIR DEHUMIDIFICATION SYSTEMS FMC CORP (US) 2004-08-18 EP claimed
US-6503420-B1 Such as lithium chloride and 2-phosphono-1,2,4-butanetri-carboxylic acid; environmentally friendly; efficient; durability FMC CORPORATION 2003-01-07 US claimed
EP-3263688-A1 IMPROVED SHINE IN SOFT WATER The Procter & Gamble Company (US) 2018-01-03 EP disclosed
EP-3263687-A1 ANTIMICROBIAL HARD SURFACE CLEANING COMPOSITION The Procter & Gamble Company (US) 2018-01-03 EP disclosed
US-7179403-B2 Anti-corrosion solutions for air dehumidification systems FMC CORPORATION (US) 2007-02-20 US disclosed
EP-1185355-B1 ANTI-CORROSION SOLUTIONS FOR AIR DEHUMIDIFICATION SYSTEMS FMC CORP (US) 2004-08-18 EP disclosed
US-20030098441-A1 Anti-corrosion solutions for air dehumidification systems VERMA SHYAM KUMAR (US) 2003-05-29 US disclosed
US-6503420-B1 Such as lithium chloride and 2-phosphono-1,2,4-butanetri-carboxylic acid; environmentally friendly; efficient; durability FMC CORPORATION 2003-01-07 US disclosed
EP-1185355-A1 ANTI-CORROSION SOLUTIONS FOR AIR DEHUMIDIFICATION SYSTEMS FMC CORPORATION (US) 2002-03-13 EP disclosed
WO-2000067878-A1 ANTI-CORROSION SOLUTIONS FOR AIR DEHUMIDIFICATION SYSTEMS FMC CORPORATION (US) 2000-11-16 WO disclosed
EP-0311070-A2 Compositions containing phosphonalkane carboxylic acid for scale inhibition THE B.F. GOODRICH COMPANY (US) 1989-04-12 EP disclosed
US-4784774-A ACRYLIC COPOLYMER FOR SCALE INHIBITION THE B. F. GOODRICH COMPANY (US) 1988-11-15 US disclosed
US-4652377-A Inhibition of alkaline earth sulfate scales THE BF GOODRICH COMPANY (US) 1987-03-24 US disclosed
EP-0171049-A2 Calcium sulfate inhibition The B.F. GOODRICH Company (US) 1986-02-12 EP disclosed
US-4563284-A ANTISCALING AGENTS THE B. F. GOODRICH COMPANY (US) 1986-01-07 US disclosed
US-4026815-A ADDING A PHOSPHONOCARBOXYLIC ACID AND A BENZIMIDAZOLE DERIVATIVE BAYER AKTIENGESELLSCHAFT (DT) 1977-05-31 US disclosed