SCHEMBL23089908

SCHEMBL23089908

Brc1ccc(-c2ccoc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.46
ALDH1A1 P00352 4/20 0.46
MAPK1 P28482 3/20 0.46
LPL P06858 1/20 0.46
LIPG Q9Y5X9 1/20 0.46
ERN1 O75460 3/20 0.40
CYP2A6 P11509 1/20 0.40
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
CA12 O43570 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
TOP2A P11388 1/20 0.35
NPBWR1 P48145 1/20 0.35
GAA P10253 1/20 0.34
KMT2A Q03164 4/20 0.34
CYP1A2 P05177 3/20 0.34
CYP3A4 P08684 3/20 0.34

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
SCHEMBL1772039 0.87 LPL (0.54) ALDH1A1MAPK1LPLLIPGERN1
SCHEMBL7191487 0.81 LPL (0.46) ALDH1A1MAPK1LPLLIPGERN1
SCHEMBL5781692 0.77 CTRC (0.48) ALDH1A1MAPK1LPLLIPGERN1
SCHEMBL571400 0.76
SCHEMBL10670976 0.75 PARP1 (0.50) ACHEALDH1A1MAPK1LPLLIPG
SCHEMBL3298791 0.75 LPL (0.46) ALDH1A1MAPK1LPLLIPGERN1
SCHEMBL11677935 0.75 CNR1 (0.46) ACHELPLLIPGERN1CYP2A6
SCHEMBL24196017 0.75 LPL (0.46) ALDH1A1MAPK1LPLLIPGERN1
SCHEMBL1016530 0.75 ALDH1A1 (0.55) ALDH1A1LPLLIPGERN1SLC6A4
SCHEMBL11678582 0.75 LPL (0.50) ACHEALDH1A1MAPK1LPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11352450-B2 Photopolymerization sensitizer composition KAWASAKI KASEI CHEMICALS LTD. (JP) 2022-06-07 US claimed
CN-111868105-B Photopolymerizable sensitizer composition 川崎化成工业株式会社 2022-05-13 CN claimed
US-20210079127-A1 PHOTOPOLYMERIZATION SENSITIZER COMPOSITION KAWASAKI KASEI CHEMICALS LTD. (JP) 2021-03-18 US claimed
US-11352450-B2 Photopolymerization sensitizer composition KAWASAKI KASEI CHEMICALS LTD. (JP) 2022-06-07 US disclosed
CN-111868105-B Photopolymerizable sensitizer composition 川崎化成工业株式会社 2022-05-13 CN disclosed
US-20210079127-A1 PHOTOPOLYMERIZATION SENSITIZER COMPOSITION KAWASAKI KASEI CHEMICALS LTD. (JP) 2021-03-18 US disclosed