SCHEMBL20524412

SCHEMBL20524412

CN(CC(=O)c1ccc2c(c1)OCO2)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.61
CTNNB1 P35222 5/20 0.58
WNT3A P56704 5/20 0.58
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
ALDH1A1 P00352 3/20 0.57
MAPK1 P28482 1/20 0.57
KDM4E B2RXH2 1/20 0.52
MAPK9 P45984 1/20 0.52
RAB9A P51151 1/20 0.52
SRD5A2 P31213 1/20 0.51
ATM Q13315 1/20 0.51
MAOB P27338 2/20 0.51
GAA P10253 1/20 0.51
TSHR P16473 1/20 0.51
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 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
SCHEMBL9436940 0.88 MEN1 (0.57) HPGDCTNNB1WNT3AMEN1KMT2A
SCHEMBL24443509 0.81 MEN1 (0.53) HPGDCTNNB1WNT3AMEN1KMT2A
SCHEMBL9436983 0.80 HPGD (0.53) HPGDCTNNB1WNT3AMEN1KMT2A
SCHEMBL1092123 0.78 ATM (0.81) HPGDCTNNB1WNT3AMEN1KMT2A
SCHEMBL29639737 0.78 ATM (0.81) HPGDCTNNB1WNT3AMEN1KMT2A
SCHEMBL15969068 0.78 CTNNB1 (0.64) HPGDCTNNB1WNT3AMEN1KMT2A
SCHEMBL29458253 0.77 MEN1 (0.76) HPGDCTNNB1WNT3AMEN1KMT2A
SCHEMBL2237626 0.77 MEN1 (0.76) HPGDCTNNB1WNT3AMEN1KMT2A
SCHEMBL109220 0.77 HPGD (0.70) HPGDCTNNB1WNT3AMEN1KMT2A
SCHEMBL5381632 0.76 MEN1 (0.69) HPGDCTNNB1WNT3AMEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3601232-A1 COMPOSITIONS AND METHODS COMPRISING SUBSTITUTED 2-AMINOIMIDAZOLES Curza Global LLC (US) 2020-02-05 EP disclosed
WO-2018184019-A1 COMPOSITIONS AND METHODS COMPRISING SUBSTITUTED 2-AMINOIMIDAZOLES CURZA GLOBAL, LLC (US) 2018-10-04 WO disclosed