SCHEMBL31336302

SCHEMBL31336302

OB(O)c1cccc(-c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.51
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
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
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
ENPP2 Q13822 3/20 0.38
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 3/20 0.37
MAPT P10636 2/20 0.37
HPGD P15428 2/20 0.37
MPI P34949 1/20 0.37

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
SCHEMBL12424867 1.00 MGLL (0.51) MGLLCA1CA2PLGF12
SCHEMBL29563619 0.89 MGLL (0.42) MGLLCA1CA2PLGF12
SCHEMBL24414652 0.89 MGLL (0.42) MGLLCA1CA2PLGF12
SCHEMBL29610130 0.87 MGLL (0.58) MGLLCA1CA2PLGF12
SCHEMBL622947 0.87 MGLL (0.58) MGLLCA1CA2PLGF12
SCHEMBL29306850 0.87 CA1 (0.53) MGLLCA1CA2PLGF12
SCHEMBL13024035 0.87 MGLL (0.67) MGLLCA1CA2PLGF12
SCHEMBL20622989 0.84 CA1 (0.46) MGLLCA1CA2PLGF12
SCHEMBL1191141 0.84 CA1 (0.47) MGLLCA1CA2MEN1KMT2A
SCHEMBL14981728 0.84 MGLL (0.59) 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-113631543-B Organic electroluminescent element and electronic device using the same 出光兴产株式会社 2025-01-17 CN disclosed