SCHEMBL29015796

SCHEMBL29015796

O=C(O)C(c1cnnnc1)C(O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 1/20 0.50
▸ LMNA P02545 4/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ SRC P12931 2/20 0.41
▸ AOC3 Q16853 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ ADRA2A P08913 1/20 0.37
▸ ADRA2C P18825 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ CES2 O00748 1/20 0.36
▸ CES1 P23141 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
SCHEMBL5178065 0.82 CYP2D6 (0.73) CYP2D6LMNAMAPK1SRCAOC3
SCHEMBL6505819 0.77 SMN1; SMN2 (0.58) CYP2D6LMNAMAPK1ALDH1A1SMN1; SMN2
SCHEMBL27906641 0.70 CYP2D6 (0.58) CYP2D6LMNAMAPK1SRCAOC3
SCHEMBL4543120 0.69 CYP2D6 (0.47) CYP2D6LMNAMAPK1SRC
SCHEMBL11315838 0.69 CYP2D6 (1.00) CYP2D6LMNAMAPK1SRCCES2
SCHEMBL659768 0.69 CYP2D6 (1.00) CYP2D6LMNAMAPK1SRCCES2
SCHEMBL7815004 0.69 CYP2D6 (1.00) CYP2D6LMNAMAPK1SRCCES2
SCHEMBL7824857 0.69 CYP2D6 (1.00) CYP2D6LMNAMAPK1SRCCES2
SCHEMBL21939337 0.68 CYP2D6 (0.76) CYP2D6LMNAMAPK1SRCALDH1A1
SCHEMBL3192877 0.68 LMNA (0.58) CYP2D6LMNAMAPK1SRCALDH1A1

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-109891320-B Metal oxide photosensitive resin composition, color filter and image display device manufactured using the same 东友精细化工有限公司 2023-06-20 — — CN disclosed
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