SCHEMBL29035604

SCHEMBL29035604

CCOc1cccc(C(=O)[O-])c1OCC.CCOc1cccc(C(=O)[O-])c1OCC.CCOc1cccc(C(=O)[O-])c1OCC.[In+3]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 2/20 0.47
GLA P06280 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
FABP3 P05413 2/20 0.43
FABP4 P15090 2/20 0.43
FABP5 Q01469 2/20 0.43
KCNK3 O14649 1/20 0.43
KCNK9 Q9NPC2 1/20 0.43
GAA P10253 2/20 0.42
MAPT P10636 2/20 0.42
MRGPRX4 Q96LA9 1/20 0.42
MAPK1 P28482 1/20 0.42
NPSR1 Q6W5P4 2/20 0.41
TSHR P16473 2/20 0.40
HTT P42858 1/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL2108364 0.84 HCRTR1 (0.51) HCRTR1GLAL3MBTL1MEN1KMT2A
SCHEMBL690705 0.83 CYP3A4 (0.53) HCRTR1GLAL3MBTL1MEN1KMT2A
SCHEMBL29768766 0.83 MAPK1 (0.53) HCRTR1GLAL3MBTL1MEN1KMT2A
SCHEMBL3424538 0.83 MAPK1 (0.53) HCRTR1GLAL3MBTL1MEN1KMT2A
SCHEMBL11059263 0.82 KMT2A (0.45) L3MBTL1MEN1KMT2AGAAMAPT
SCHEMBL3189724 0.81 TSHR (0.53) HCRTR1GLAL3MBTL1MEN1KMT2A
SCHEMBL27574878 0.81 HCRTR1 (0.49) HCRTR1GLAL3MBTL1MEN1KMT2A
SCHEMBL9653311 0.81 HCRTR1 (0.49) HCRTR1GLAL3MBTL1MEN1KMT2A
Zinc Ion SCHEMBL2003364 0.81 HCRTR1 (0.60) HCRTR1GLAL3MBTL1MEN1KMT2A
SCHEMBL31721706 0.81 HCRTR1 (0.60) HCRTR1GLAL3MBTL1MEN1KMT2A

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-109716491-B Method for manufacturing field effect transistor and method for manufacturing wireless communication device 东丽株式会社 2023-06-09 CN disclosed