SCHEMBL2470935

SCHEMBL2470935

C=C(C)C(=O)OCCCCCCOP(=O)(O)Oc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
APEX1 P27695 1/20 0.52
HTT P42858 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
TSHR P16473 2/20 0.47
ALDH1A1 P00352 1/20 0.46
SRC P12931 1/20 0.38
P2RY10 O00398 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
ELANE P08246 1/20 0.36

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
SCHEMBL5270751 0.94 POLB (0.47) POLBAPEX1HTTTDP1TSHR
SCHEMBL105672 0.91 ALDH1A1 (0.49) POLBAPEX1HTTTDP1TSHR
Phosphoric Acid SCHEMBL17764817 0.90 ALDH1A1 (0.48) POLBAPEX1HTTTDP1TSHR
SCHEMBL28104073 0.85 POLB (0.43) POLBAPEX1HTTTDP1ALDH1A1
SCHEMBL17488930 0.85 ALDH1A1 (0.43) POLBAPEX1HTTTDP1TSHR
SCHEMBL6234773 0.85 POLB (0.46) POLBAPEX1HTTTDP1TSHR
SCHEMBL3691946 0.84 POLB (0.48) POLBAPEX1HTTTDP1TSHR
SCHEMBL17488997 0.83 SRC (0.53) POLBTDP1TSHRALDH1A1SRC
SCHEMBL28575474 0.83 ALDH1A1 (0.43) POLBAPEX1HTTTDP1TSHR
SCHEMBL7052527 0.82 POLB (0.50) POLBAPEX1HTTTDP1TSHR

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
EP-2374444-B1 Dental covering material VOCO GMBH (DE) 2017-03-01 EP claimed
EP-2374444-A2 Dental covering material VOCO GmbH (DE) 2011-10-12 EP claimed
EP-3011949-B1 CURABLE DENTAL MATERIAL VOCO GMBH (DE) 2021-05-05 EP disclosed
EP-2436364-B1 Varnish compound comprising a monomer with a polyalicyclic structure element VOCO GMBH (DE) 2017-05-31 EP disclosed
EP-2436365-B1 Composite material comprising a monomer with a polyalicyclic structure element VOCO GMBH (DE) 2017-03-08 EP disclosed
EP-2374444-B1 Dental covering material VOCO GMBH (DE) 2017-03-01 EP disclosed
EP-3011949-A1 CURABLE DENTAL MATERIAL VOCO GmbH (DE) 2016-04-27 EP disclosed
EP-2374445-B1 Dual hardening multi-component dental composition VOCO GMBH (DE) 2015-07-29 EP disclosed
EP-2436366-B1 Composite material comprising a monomer with a polyalicyclic structure as sealing material VOCO GMBH (DE) 2015-07-29 EP disclosed
EP-2374444-A2 Dental covering material VOCO GmbH (DE) 2011-10-12 EP disclosed
EP-2374445-A2 Dual hardening multi-component dental composition VOCO GmbH (DE) 2011-10-12 EP disclosed