SCHEMBL10053233

SCHEMBL10053233

CB1OCc2cc(F)ccc21

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.62
CA2 P00918 4/20 0.62
PDE3A Q14432 1/20 0.62
PDE4A P27815 6/20 0.44
PDE4B Q07343 6/20 0.44
PDE4C Q08493 6/20 0.44
PDE4D Q08499 6/20 0.44
CA12 O43570 3/20 0.34
CA9 Q16790 3/20 0.34
NOTUM Q6P988 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
SCHEMBL23865051 0.85 CA1 (0.49) CA1CA2PDE3APDE4APDE4B
SCHEMBL18016972 0.78 CA1 (0.65) CA1CA2PDE3APDE4APDE4B
SCHEMBL10053217 0.78 PDE4A (0.45) CA1CA2PDE3APDE4APDE4B
SCHEMBL18500980 0.77 PDE4A (0.44) CA1CA2PDE3APDE4APDE4B
SCHEMBL19171231 0.77 CA1 (1.00) CA1CA2PDE3APDE4APDE4B
Tavaborole SCHEMBL29372574 0.77 CA1 (1.00) CA1CA2PDE3APDE4APDE4B
Tavaborole SCHEMBL596052 0.77 CA1 (1.00) CA1CA2PDE3APDE4APDE4B
Tavaborole SCHEMBL500016 0.77 CA1 (1.00) CA1CA2PDE3APDE4APDE4B
SCHEMBL14470675 0.77 CA1 (0.62) CA1CA2PDE3APDE4APDE4B
SCHEMBL15186225 0.77 CA1 (0.62) CA1CA2PDE3APDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240206470-A1 VOLATILE APPLICATIONS AGAINST PATHOGENS AGROFRESH INC (US) 2024-06-27 US disclosed
US-20240206470-A1 VOLATILE APPLICATIONS AGAINST PATHOGENS AGROFRESH INC (US) 2024-06-27 US disclosed
US-11771089-B2 Large-scale methods of uniformly coating packaging surfaces with a volatile antimicrobial to preserve food freshness AGROFRESH INC. (US) 2023-10-03 US disclosed
US-11771089-B2 Large-scale methods of uniformly coating packaging surfaces with a volatile antimicrobial to preserve food freshness AGROFRESH INC. (US) 2023-10-03 US disclosed
US-11773114-B2 Protective groups and methods for protecting benzoxaboroles or oxaboroles SAINT JOSEPH'S UNIVERSITY (US) 2023-10-03 US disclosed
US-11766043-B2 Vaporized administration of pesticides AGROFRESH INC. (US) 2023-09-26 US disclosed
US-11766043-B2 Vaporized administration of pesticides AGROFRESH INC. (US) 2023-09-26 US disclosed
US-20220361503-A1 LARGE-SCALE METHODS OF UNIFORMLY COATING PACKAGING SURFACES WITH A VOLATILE ANTIMICROBIAL TO PRESERVE FOOD FRESHNESS ALTER DOMUS US LLC 2022-11-17 US disclosed
WO-2022094214-A1 TREATMENT AND SYSTEM FOR CANNABIS PLANT SPECIES APPLICATIONS WITH ETHYLENE INHIBITORS AGROFRESH INC. (US) 2022-05-05 WO disclosed
US-20220125049-A1 METHOD AND SYSTEM FOR CENTRALIZED MANAGEMENT, MONITORING, AND CONTROLLED DELIVERY OF BIOLOGICAL COMPOUNDS TO FRUIT STORAGE ROOMS ALTER DOMUS US LLC 2022-04-28 US disclosed
US-20150223466-A1 VOLATILE APPLICATIONS AGAINST PATHOGENS DOW AGROSCIENCES LLC (US) 2015-08-13 US disclosed
US-20150223466-A1 VOLATILE APPLICATIONS AGAINST PATHOGENS DOW AGROSCIENCES LLC (US) 2015-08-13 US disclosed
EP-2810946-A1 1,1'-[1,omega-alkyldiylbis(oxy)]bis[1,3-dihydro-2,1-benzoxaborole as volatile antimicrobial compounds Dow AgroSciences LLC (US) 2014-12-10 EP disclosed
US-20140349853-A1 USE OF BENZOXABOROLES AS VOLATILE ANTIMICROBIAL AGENTS ON MEATS, PLANTS, OR PLANT PARTS DOW AGROSCIENCES LLC (US) 2014-11-27 US disclosed
US-20140213551-A1 COMPOUNDS AND COMPOSITIONS DOW AGROSCIENCE LLC (US) 2014-07-31 US disclosed
US-20140213551-A1 COMPOUNDS AND COMPOSITIONS DOW AGROSCIENCE LLC (US) 2014-07-31 US disclosed
US-8669207-B1 Compounds and compositions DOW AGROSCIENCES, LLC. (US) 2014-03-11 US disclosed
US-8669207-B1 Compounds and compositions DOW AGROSCIENCES, LLC. (US) 2014-03-11 US disclosed
US-8106031-B2 Hydrolytically-resistant boron-containing therapeutics and methods of use ANACOR PHARMACEUTICALS, INC. (US) 2012-01-31 US disclosed
US-8106031-B2 Hydrolytically-resistant boron-containing therapeutics and methods of use ANACOR PHARMACEUTICALS, INC. (US) 2012-01-31 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11773114-B2 Protective groups and methods for protecting benzoxaboroles or oxaboroles TXN2, ABCB7, TXN CA1 822/4885CA2 1060/4885PDE3A 4030/4885
US-20140349853-A1 USE OF BENZOXABOROLES AS VOLATILE ANTIMICROBIAL AGENTS ON MEATS, PLANTS, OR PLANT PARTS OXA1L, BROX, BOLA2; BOLA2B CA1 4683/4885CA2 3828/4885PDE3A 2610/4885
US-20240206470-A1 VOLATILE APPLICATIONS AGAINST PATHOGENS OXA1L, VAPB, TIAL1 CA1 3741/4885CA2 3017/4885PDE3A 3288/4885
US-11766043-B2 Vaporized administration of pesticides GPX4, CAT, PRDX2 CA1 1562/4885CA2 710/4885PDE3A 1183/4885
US-20140213551-A1 COMPOUNDS AND COMPOSITIONS OXA1L, CUL3, CUL2 CA1 3015/4885CA2 2198/4885PDE3A 1840/4885
US-20150223466-A1 VOLATILE APPLICATIONS AGAINST PATHOGENS OXA1L, TIAL1, VAPB CA1 3291/4885CA2 2191/4885PDE3A 3018/4885
US-11771089-B2 Large-scale methods of uniformly coating packaging surfaces with a volatile antimicrobial to preserve food freshness TAS2R10, FOSB, TMBIM6 CA1 3929/4885CA2 3745/4885PDE3A 2224/4885
US-20220125049-A1 METHOD AND SYSTEM FOR CENTRALIZED MANAGEMENT, MONITORING, AND CONTROLLED DELIVERY OF BIOLOGICAL COMPOUNDS TO FRUIT STORAGE ROOMS NEFM, BIRC8, TNF CA1 2003/4885CA2 1480/4885PDE3A 2890/4885
US-20220361503-A1 LARGE-SCALE METHODS OF UNIFORMLY COATING PACKAGING SURFACES WITH A VOLATILE ANTIMICROBIAL TO PRESERVE FOOD FRESHNESS TAS2R10, FOSB, TMBIM6 CA1 3929/4885CA2 3745/4885PDE3A 2224/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.