SCHEMBL28923527

SCHEMBL28923527

Cc1c(C)c(C)c2c(-c3cccc4ccccc34)c3cc(-c4ccccc4)ccc3c(-c3cccc4ccccc34)c2c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 4/20 0.42
▸ CA1 P00915 4/20 0.42
▸ CA2 P00918 4/20 0.42
▸ CA9 Q16790 4/20 0.42
▸ DHFR P00374 1/20 0.38
▸ SLC6A9 P48067 1/20 0.37
▸ MCL1 Q07820 1/20 0.37
▸ ACMSD Q8TDX5 1/20 0.37
▸ ENPP3 O14638 1/20 0.37
▸ ENPP1 P22413 1/20 0.37
▸ ATM Q13315 3/20 0.36
▸ HSD17B10 Q99714 3/20 0.36
▸ HPGD P15428 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ MAPT P10636 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
SCHEMBL12231078 0.86 CA12 (0.49) CA12CA1CA2CA9DHFR
SCHEMBL28360030 0.86 CA12 (0.49) CA12CA1CA2CA9DHFR
SCHEMBL30744707 0.86 CA12 (0.49) CA12CA1CA2CA9DHFR
SCHEMBL28023090 0.84 DHFR (0.49) DHFRENPP3ENPP1ATMHSD17B10
SCHEMBL23988465 0.82 CA12 (0.46) CA12CA1CA2CA9SLC6A9
SCHEMBL2955115 0.81 CA12 (0.45) CA12CA1CA2CA9DHFR
SCHEMBL20433933 0.81 CA12 (0.51) CA12CA1CA2CA9MCL1
SCHEMBL24922893 0.80 CA12 (0.43) CA12CA1CA2CA9MCL1
SCHEMBL29295440 0.80 CA12 (0.54) CA12CA1CA2CA9MCL1
SCHEMBL23879787 0.80 CA12 (0.43) CA12CA1CA2CA9MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115551865-A Organic compound, light-emitting device, light-emitting apparatus, electronic device, display apparatus, and lighting apparatus 株式会社半导体能源研究所 2022-12-30 — — CN disclosed
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