SCHEMBL31248314

SCHEMBL31248314

O=C(O)C1C2C=CC(C2)C1C(=O)OC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.48
ALDH1A1 P00352 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
LMNA P02545 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
APEX1 P27695 1/20 0.41
CYP19A1 P11511 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
CASP6 P55212 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL12149604 0.77 ALDH1A1 (0.55) POLBALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL12017794 0.77 POLB (0.44) POLBALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL572756 0.75 POLB (0.59) POLBALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL27495 0.75 POLB (0.59) POLBALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL3787744 0.75 POLB (0.59) POLBALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL3777075 0.75 POLB (0.59) POLBALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL4665372 0.75 POLB (0.59) POLBALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL12936903 0.75 POLB (0.49) POLBALDH1A1SMN1; SMN2LMNATDP1
SCHEMBL24062391 0.74 POLB (0.70) POLBALDH1A1SMN1; SMN2TDP1APEX1
SCHEMBL1462188 0.74 POLB (0.70) POLBALDH1A1SMN1; SMN2TDP1APEX1

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-118791669-A Intrinsic dynamic color-adjustable cycloolefin copolymer long afterglow material and application thereof 重庆理工大学 2024-10-18 CN disclosed