SCHEMBL8557773

SCHEMBL8557773

CO/C=C(/Cc1csc2nc(COc3ccc(Cl)cc3Cl)cn12)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
RXFP1 Q9HBX9 1/20 0.48
MRGPRX4 Q96LA9 13/20 0.45
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
TPH1 P17752 1/20 0.36
ADRB2 P07550 1/20 0.36

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
SCHEMBL8556961 0.87 MAPT (0.45) POLBRXFP1MRGPRX4TP53MAPT
SCHEMBL8553136 0.82 SMN1; SMN2 (0.41) POLBRXFP1TP53MAPTHPGD
SCHEMBL8553904 0.81 THRB (0.40) POLBTP53MAPTHPGDNPC1
SCHEMBL8556548 0.77 THRB (0.53) TP53MAPT
SCHEMBL8556217 0.74 MAPK9 (0.41) TP53MAPT
SCHEMBL8556456 0.71 TP53 (0.36) TP53MAPTHPGD
SCHEMBL8556454 0.71 TP53 (0.36) TP53MAPTHPGD
SCHEMBL8557547 0.70 TP53 (0.51) RXFP1TP53MAPTHPGDNPC1
SCHEMBL8557170 0.70 TP53 (0.46) POLBRXFP1TP53MAPTRAB9A
SCHEMBL8556427 0.70 SIRT1 (0.47) POLBTP53MAPTHPGDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0554957-B1 Thiazole derivatives of alkoxyacrylates with a fungicidal activity MINI RICERCA SCIENT TECNOLOG (IT) 1998-04-15 EP disclosed
US-5334609-A Used in agriculture MINISTERO DELL'UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECHNOLOGICA (IT) 1994-08-02 US disclosed
EP-0554957-A2 Thiazole derivatives of alkoxyacrylates with a fungicidal activity MINISTERO DELL' UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECNOLOGICA (IT) 1993-08-11 EP disclosed