SCHEMBL29634618

SCHEMBL29634618

OB(O)c1cccc(-c2cccc3ccc4ccccc4c23)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.51
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
PLG P00747 1/20 0.40
F12 P00748 1/20 0.40
F11 P03951 1/20 0.40
KLKB1 P03952 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
ENPP2 Q13822 4/20 0.38
ALDH1A1 P00352 2/20 0.37
CYP1A2 P05177 1/20 0.37
THRB P10828 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
KDM4E B2RXH2 2/20 0.37
CDK4 P11802 2/20 0.37
CCND1 P24385 2/20 0.37
MCL1 Q07820 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
SCHEMBL622947 0.87 MGLL (0.58) MGLLCA1CA2PLGF12
SCHEMBL29610130 0.87 MGLL (0.58) MGLLCA1CA2PLGF12
SCHEMBL26654156 0.86 MGLL (0.53) MGLLCA1CA2PLGF12
SCHEMBL31277618 0.86 MGLL (0.53) MGLLCA1CA2PLGF12
SCHEMBL14981728 0.84 MGLL (0.59) MGLLCA1CA2PLGF12
SCHEMBL29634609 0.84 CA1 (0.46) MGLLCA1CA2ENPP2ALDH1A1
SCHEMBL28468026 0.83 MGLL (0.58) MGLLCA1CA2PLGF12
SCHEMBL3859747 0.79 MGLL (0.49) MGLLCA1CA2PLGF12
SCHEMBL1092564 0.79 MGLL (0.56) MGLLCA1CA2PLGF12
SCHEMBL12424867 0.78 MGLL (0.51) MGLLCA1CA2PLGF12

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-109111411-B Light extraction layer material and application thereof 湖北尚赛光电材料有限公司 2022-06-14 CN disclosed