SCHEMBL6705590

SCHEMBL6705590

C=CCC12OCC(CO)(CO1)CO2

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL10933741 0.78
SCHEMBL11059636 0.78
SCHEMBL10396189 0.70
SCHEMBL712650 0.70 EPHX1 (0.33)
SCHEMBL11059632 0.69
SCHEMBL10966623 0.67 TSHR (0.33)
SCHEMBL40172 0.64 EPHX1 (0.42)
SCHEMBL1565610 0.64
SCHEMBL10785209 0.64
SCHEMBL17627917 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4338240-A Curable material and process for production thereof TOAGOESI CHEMICAL INDUSTRY CO., LTD. (JP) 1982-07-06 US claimed
JP-57021417-A None JP disclosed
JP-56108792-A None JP disclosed
JP-62209134-A None JP disclosed
JP-2004277579-A METHOD FOR CURING CATIONICALLY POLYMERIZABLE COMPOSITION AND CURED PRODUCT THEREOF TOPPAN PRINTING CO LTD 2004-10-07 JP disclosed
JP-S62209134-A PRODUCTION OF CARBONATE POLYMER IDEMITSU PETROCHEM CO LTD 1987-09-14 JP disclosed
US-4338240-A Curable material and process for production thereof TOAGOESI CHEMICAL INDUSTRY CO., LTD. (JP) 1982-07-06 US disclosed
US-4338240-A Curable material and process for production thereof TOAGOESI CHEMICAL INDUSTRY CO., LTD. (JP) 1982-07-06 US disclosed
JP-S5721417-A PRODUCTION OF CURING COMPOSITION TOAGOSEI CHEM IND CO LTD 1982-02-04 JP disclosed
JP-S56108792-A 1-ALKYL-4-HYDROXYMETHYL-2,6,7-TRIOXABICYCLO 2,2,2 OCTANE TOAGOSEI CHEM IND CO LTD 1981-08-28 JP disclosed