SCHEMBL28704042

SCHEMBL28704042

CON1c2ccccc2SC1O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 5/20 0.39
▸ MAOA P21397 1/20 0.35
▸ NOX1 Q9Y5S8 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ LMNA P02545 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ NOTUM Q6P988 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ GSK3B P49841 1/20 0.33

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
SCHEMBL28121191 0.75 BCHE (0.37) BCHEMAOAKDM4ERAB9ANPC1
SCHEMBL32662573 0.75 MAOA (0.43) BCHEMAOANOX1ALDH1A1HPGD
SCHEMBL28890315 0.74 ALDH1A1 (0.38) BCHEMAOAKDM4ERAB9ANPC1
SCHEMBL28714775 0.72 BCHE (0.36) BCHEMAOANOX1LMNAACHE
SCHEMBL28712786 0.68 GSK3B (0.35) BCHEMAOANOX1ALDH1A1HPGD
SCHEMBL27926326 0.64 BCHE (0.38) BCHEMAOAALDH1A1SMN1; SMN2GSK3B
SCHEMBL28916911 0.63 BCHE (0.37) BCHEMAOAALDH1A1SMN1; SMN2LMNA
SCHEMBL16709169 0.62 MAOA (0.38) MAOASMN1; SMN2GSK3B
SCHEMBL12264201 0.61 MAOA (0.46) BCHEMAOANOX1RAB9AALDH1A1
SCHEMBL627994 0.61 MAOA (0.58) BCHEMAOANOX1LMNAACHE

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
CN-109160906-B Application of acryloyl ester compound taking thiazole as matrix as fluorescent probe and preparation method thereof 西北农林科技大学 2022-04-01 — — CN disclosed
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