SCHEMBL27360757

SCHEMBL27360757

O=Nc1cc(O)cc2oc(O)c(-c3ccc(O)cc3O)c(=O)c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.50
BACE1 P56817 3/20 0.50
PTPN1 P18031 3/20 0.50
ESR2 Q92731 3/20 0.50
MAPT P10636 3/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
APP P05067 3/20 0.50
MPG P29372 2/20 0.50
POLB P06746 2/20 0.50
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
TP53 P04637 2/20 0.50
YES1 P07947 2/20 0.50
CYP3A4 P08684 2/20 0.50
CYP2C9 P11712 2/20 0.50
HPGD P15428 2/20 0.50
ALOX15 P16050 2/20 0.50
CSNK2A2 P19784 2/20 0.50
XDH P47989 2/20 0.50

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
SCHEMBL24683517 0.91 GAA (0.56) GAABACE1PTPN1ESR2MAPT
SCHEMBL14685804 0.86 GAA (0.66) GAABACE1PTPN1ESR2MAPT
SCHEMBL4104591 0.72 MEN1 (0.64) GAABACE1PTPN1ESR2MAPT
SCHEMBL26372938 0.71 MAOA (0.69) GAAPTPN1ESR2XDHPLK1
SCHEMBL30170794 0.70 GAA (0.59) GAABACE1PTPN1ESR2MAPT
SCHEMBL13964377 0.68 MEN1 (0.74) GAABACE1PTPN1MAPTMEN1
Morin SCHEMBL10335390 0.67 MEN1 (1.00) GAABACE1PTPN1ESR2MAPT
Morin SCHEMBL19984 0.67 MEN1 (1.00) GAABACE1PTPN1ESR2MAPT
Morin SCHEMBL29435805 0.67 MEN1 (1.00) GAABACE1PTPN1ESR2MAPT
Morin SCHEMBL29929115 0.67 MEN1 (1.00) GAABACE1PTPN1ESR2MAPT

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
EP-4119360-B1 TIRE BRIDGESTONE CORP (JP) 2024-07-03 EP disclosed