SCHEMBL27264595

SCHEMBL27264595

C#CC(=O)N(c1ccc(F)cc1)C(C(=O)NCCc1ccccc1)c1cccs1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GPX4 P36969 8/20 0.68
▸ LMNA P02545 4/20 0.54
▸ NPC1 O15118 4/20 0.54
▸ RAB9A P51151 4/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ MAPT P10636 1/20 0.54
▸ YAP1 P46937 1/20 0.54
▸ PAX8 Q06710 1/20 0.54
▸ TEAD4 Q15561 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54
▸ PIK3C3 Q8NEB9 1/20 0.54
▸ POLB P06746 1/20 0.43

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
SCHEMBL27264417 0.93 GPX4 (0.71) GPX4LMNANPC1RAB9ASMN1; SMN2
SCHEMBL27264422 0.90 GPX4 (0.66) GPX4LMNANPC1RAB9ASMN1; SMN2
SCHEMBL27264584 0.88 GPX4 (0.75) GPX4LMNANPC1RAB9ASMN1; SMN2
SCHEMBL27264826 0.87 GPX4 (0.71) GPX4LMNANPC1RAB9ASMN1; SMN2
SCHEMBL27264725 0.86 GPX4 (0.61) GPX4LMNANPC1RAB9ASMN1; SMN2
SCHEMBL27264423 0.85 GPX4 (0.72) GPX4LMNANPC1RAB9ASMN1; SMN2
SCHEMBL27264592 0.85 GPX4 (0.64) GPX4LMNANPC1RAB9ASMN1; SMN2
SCHEMBL27264823 0.84 GPX4 (0.63) GPX4LMNANPC1RAB9ASMN1; SMN2
SCHEMBL27264585 0.83 GPX4 (0.74) GPX4LMNANPC1RAB9ASMN1; SMN2
SCHEMBL27264598 0.83 GPX4 (0.74) GPX4LMNANPC1RAB9ASMN1; SMN2

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
WO-2024030651-A1 GPX4 INHIBITORS AND USE THEREOF SONATA THERAPEUTICS, INC. (US) 2024-02-08 — — WO disclosed
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