SCHEMBL30456847

SCHEMBL30456847

O=C([O-])c1cccc2c1OCO2.O=C([O-])c1cccc2c1OCO2.[Sn+2]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
POLB P06746 1/20 0.42
MAPK1 P28482 1/20 0.42
LMNA P02545 1/20 0.42
GSK3B P49841 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.40
CTNNB1 P35222 3/20 0.38
WNT3A P56704 3/20 0.38
MT-CO2 P00403 1/20 0.38
PARP1 P09874 1/20 0.38
MGAM O43451 1/20 0.37
AMY1A P0DUB6 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
TXNRD1 Q16881 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
SCHEMBL30457603 0.96 MAOB (0.42) MAOBKDM4EALDH1A1HPGDPOLB
SCHEMBL1720148 0.84 PARP1 (0.54) KDM4EALDH1A1HPGDPOLBMAPK1
SCHEMBL29625406 0.84 PARP1 (0.54) KDM4EALDH1A1HPGDPOLBMAPK1
SCHEMBL6206600 0.83 ABCG2 (0.44) MAOBKDM4EALDH1A1HPGDPOLB
SCHEMBL340702 0.81 KDM4C (0.52) MAOBKDM4EALDH1A1HPGDPOLB
SCHEMBL29442138 0.81 KDM4C (0.52) MAOBKDM4EALDH1A1HPGDPOLB
SCHEMBL23079145 0.80 GSK3B (0.42) MAOBKDM4EALDH1A1HPGDPOLB
Hydrochloric Acid SCHEMBL9236405 0.80 KDM4C (0.51) MAOBKDM4EALDH1A1HPGDPOLB
SCHEMBL340356 0.80 KDM4E (0.44) MAOBKDM4EALDH1A1GSK3BKDM4C
SCHEMBL341608 0.80 GSK3B (0.42) MAOBKDM4EALDH1A1HPGDPOLB

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-116253838-A Graft copolymer for preparing binaural extraction tube and preparation method thereof 深圳市远景医疗器械模具有限公司 2023-06-13 CN disclosed