SCHEMBL6870524

SCHEMBL6870524

Cc1ccc(P(OC(C)C)OC(C)C)cc1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.38
TDP1 Q9NUW8 1/20 0.38
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CHRNA7 P36544 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
SCHEMBL6230885 0.81 ACHE (0.38) ACHETDP1CA1CA2CA7
SCHEMBL1451249 0.78 TDP1 (0.39) TDP1ALDH1A1
SCHEMBL10735520 0.77 CA1 (0.48) ACHETDP1CA1CA2CA7
SCHEMBL11443402 0.77 ALDH1A3 (0.45) ALDH1A1
SCHEMBL11438329 0.76 ALDH1A1 (0.46) TDP1ALDH1A1
SCHEMBL389944 0.72 ACHE (0.44) ACHETDP1CA1CA2CA7
SCHEMBL1727101 0.68 ACHE (0.46) ACHETDP1CA1CA2CA7
SCHEMBL25218457 0.68 ACHE (0.41) ACHETDP1CA1CA2CA9
SCHEMBL9302819 0.67 ACHE (0.44) ACHETDP1CA1CA2CA7
SCHEMBL2210588 0.67 ACHE (0.44) ACHETDP1CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020210649-A1 BICYCLIC HETEROARYL DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS RIBOSCIENCE LLC (US) 2020-10-15 WO disclosed
US-6818153-B2 Photocurable thermosetting luminescent resins BURNELL-JONES PETER (AU) 2004-11-16 US disclosed
WO-2004011571-A1 PHOTOCURABLE THERMOSETTING LUMINESCENT RESINS ORION 21 A. D. PTY LTD (AU) 2004-02-05 WO disclosed
US-20030085383-A1 For use as gel coat, laminating resin, casting resin or moldable resin; photoluminescent, thermoluminescent and electroluminescent properties BURNELL-JONES PETER (AU) 2003-05-08 US disclosed
US-4710523-A DISCOLORATION, WEAR RESISTANT SURFACE COATING, FINISHES, AND PRINTING INK BASF AKTIENGESELLSCHAFT (DE) 1987-12-01 US disclosed
EP-0057474-B1 ACYLPHOSPHINE OXDE COMPOUNDS, THEIR PREPARATION AND USE BASF Aktiengesellschaft (DE) 1984-10-17 EP disclosed
EP-0057474-A2 Acylphosphine oxde compounds, their preparation and use BASF Aktiengesellschaft (DE) 1982-08-11 EP disclosed
EP-0007086-B1 LIGHT-CURABLE MOULDING, IMPREGNATING AND COATING COMPOSITIONS AND SHAPED ARTICLES PREPARED THEREFROM BASF Aktiengesellschaft (DE) 1982-02-10 EP disclosed
US-4298738-A PHOTOINITIATORS IN PHOTOPOLYMERIZABLE COATINGS AND IMKS BASF AKTIENGESELLSCHAFT (DE) 1981-11-03 US disclosed
US-4265723-A UNSATURATED POLYESTERS OR VINYL ESTERS OF POLYEPOXIDES AND A UV SENSITIZER OF AN ACYL PHOSPHINE OXIDE BASF AKTIENGESELLSCHAFT (DE) 1981-05-05 US disclosed
EP-0007086-A1 Light-curable moulding, impregnating and coating compositions and shaped articles prepared therefrom BASF Aktiengesellschaft (DE) 1980-01-23 EP disclosed