SCHEMBL8554499

SCHEMBL8554499

CO/C=C(/Cc1csc2nc(-c3ccc(F)cc3)cn12)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.57
MAPT P10636 3/20 0.57
EGFR P00533 6/20 0.44
AKT1 P31749 6/20 0.44
AKT2 P31751 6/20 0.44
AKT3 Q9Y243 6/20 0.44
THRB P10828 1/20 0.42
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
HSD17B10 Q99714 1/20 0.40
LMNA P02545 2/20 0.39
F2RL3 Q96RI0 1/20 0.38

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
SCHEMBL8557547 0.91 TP53 (0.51) TP53MAPTEGFRAKT1AKT2
SCHEMBL8554723 0.90 TP53 (0.50) TP53MAPTEGFRAKT1AKT2
SCHEMBL8556432 0.90 TP53 (0.47) TP53MAPTEGFRAKT1AKT2
SCHEMBL8554193 0.89 TP53 (0.46) TP53MAPTEGFRAKT1AKT2
SCHEMBL8557170 0.88 TP53 (0.46) TP53MAPTEGFRAKT1AKT2
SCHEMBL8555033 0.86 MAPT (0.43) TP53MAPTEGFRAKT1AKT2
SCHEMBL8554698 0.85 TP53 (0.46) TP53MAPTEGFRAKT1AKT2
Bromide SCHEMBL30852744 0.81 TP53 (0.58) TP53MAPTEGFRAKT1AKT2
SCHEMBL8556217 0.80 MAPK9 (0.41) TP53MAPTEGFRAKT1AKT2
SCHEMBL8625711 0.79 TP53 (0.43) TP53MAPTEGFRAKT1AKT2

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