SCHEMBL5270751

SCHEMBL5270751

C=C(C)C(=O)OCCCCCCCCCCOP(=O)(O)O.C=C(C)C(=O)OCCOP(=O)(O)Oc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
APEX1 P27695 1/20 0.47
HTT P42858 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
ALDH1A1 P00352 1/20 0.42
TSHR P16473 2/20 0.42
SRC P12931 1/20 0.37
P2RY10 O00398 5/20 0.36
LPAR3 Q9UBY5 3/20 0.35
LPAR1 Q92633 2/20 0.35
LPAR2 Q9HBW0 2/20 0.35
GPR34 Q9UPC5 1/20 0.35

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
SCHEMBL2470935 0.94 POLB (0.52) POLBAPEX1HTTTDP1ALDH1A1
SCHEMBL105672 0.91 ALDH1A1 (0.49) POLBAPEX1HTTTDP1ALDH1A1
Phosphoric Acid SCHEMBL17764817 0.89 ALDH1A1 (0.48) POLBAPEX1HTTTDP1ALDH1A1
SCHEMBL17488930 0.84 ALDH1A1 (0.43) POLBAPEX1HTTTDP1ALDH1A1
SCHEMBL28104073 0.84 POLB (0.43) POLBAPEX1HTTTDP1ALDH1A1
SCHEMBL14236929 0.84 ALDH1A1 (0.40) POLBAPEX1HTTTDP1ALDH1A1
Biphenyl SCHEMBL27813450 0.80 THRB (0.42) POLBAPEX1HTTTDP1TSHR
SCHEMBL345787 0.80 TSHR (0.62) POLBAPEX1HTTTDP1ALDH1A1
SCHEMBL345385 0.80 TSHR (0.62) POLBAPEX1HTTTDP1ALDH1A1
SCHEMBL15795 0.80 TSHR (0.62) POLBAPEX1HTTTDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1431315-B1 Photopolymerization initiator and photopolymerizable composition TOKUYAMA CORP (JP) 2007-10-17 EP disclosed
US-20040186195-A1 Photopolymerization initiator and photopolymerizable composition TOKUYAMA CORPORATION (JP) 2004-09-23 US disclosed