SCHEMBL9159451

SCHEMBL9159451

C=CC(=O)OCCOC(=O)C=CC(=O)OCCOC(=O)C=C

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.73
ALDH1A1 P00352 4/20 0.73
TP53 P04637 3/20 0.73
HIF1A Q16665 3/20 0.73
HSD17B10 Q99714 1/20 0.73
CYP3A4 P08684 2/20 0.65
HPGD P15428 1/20 0.58
THRB P10828 2/20 0.52
ATM Q13315 1/20 0.50
HCAR2 Q8TDS4 6/20 0.46
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPT P10636 2/20 0.41
CACNA1B Q00975 1/20 0.41
APBA1 Q02410 1/20 0.41
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
AKR1B10 O60218 1/20 0.36
AKR1B1 P15121 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
SCHEMBL956149 1.00 TSHR (0.73) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL9159442 1.00 TSHR (0.73) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL93462 0.92 TSHR (0.84) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL30604742 0.92 TSHR (0.84) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL8892905 0.91 TSHR (0.61) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL448684 0.91 TSHR (0.61) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL4147710 0.91 TSHR (0.83) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL448685 0.91 TSHR (0.61) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL2774695 0.90 TSHR (0.74) TSHRALDH1A1TP53HIF1AHSD17B10
Ethylene SCHEMBL1165263 0.89 TSHR (0.80) TSHRALDH1A1TP53HIF1AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0353030-B1 Photopolymerization initiator and photosensitive composition employing the same CANON KK (JP) 1995-03-15 EP disclosed
US-5124235-A Photopolymerization initiator and photosensitive composition employing the same CANON KABUSHIKI KAISHA (JP) 1992-06-23 US disclosed
EP-0353030-A2 Photopolymerization initiator and photosensitive composition employing the same CANON KABUSHIKI KAISHA (JP) 1990-01-31 EP disclosed
EP-0297583-A2 Photosensitive material and image forming method by use thereof CANON KABUSHIKI KAISHA (JP) 1989-01-04 EP disclosed