SCHEMBL28699574

SCHEMBL28699574

CC(C)OC(=O)Oc1cccc2c1ccc1c3ccccc3ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
HSD17B10 Q99714 3/20 0.48
GAA P10253 2/20 0.48
PGR P06401 1/20 0.48
PTGS1 P23219 1/20 0.48
MAPK1 P28482 1/20 0.48
NCEH1 Q6PIU2 2/20 0.45
KMT2A Q03164 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
RAB9A P51151 2/20 0.43
MEN1 O00255 1/20 0.43
KDM4E B2RXH2 3/20 0.42
HPGD P15428 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
HPRT1 P00492 1/20 0.41
KCNJ11 Q14654 1/20 0.40
NR2E1 Q9Y466 1/20 0.40
MAPT P10636 3/20 0.40
POLB P06746 1/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL28379570 0.91 ALDH1A1 (0.57) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL28684572 0.86 HSD17B10 (0.55) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL18817858 0.86 HSD17B10 (0.53) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL30003452 0.84 TSHR (0.44) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL23271942 0.84 TSHR (0.44) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL28694838 0.82 ALDH1A1 (0.50) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL28685679 0.82 ALDH1A1 (0.44) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL28683213 0.81 ALDH1A1 (0.49) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL28887788 0.81 ALDH1A1 (0.42) ALDH1A1HSD17B10GAAPGRPTGS1
SCHEMBL11152562 0.80 ALDH1A1 (0.54) ALDH1A1HSD17B10GAAPGRPTGS1

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
CN-109471330-B Photosensitive composition and photopolymerization initiator used therein 东京应化工业株式会社 2023-08-29 CN disclosed
CN-106970503-B Photosensitive composition 东京应化工业株式会社 2022-02-01 CN disclosed