SCHEMBL28002684

SCHEMBL28002684

Cc1ccccc1C1=CNC(C=S)N1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DCUN1D1 Q96GG9 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ PKM P14618 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ PRNP P04156 1/20 0.32
▸ PPARG P37231 1/20 0.32
▸ MAPK10 P53779 1/20 0.32
▸ NCOA2 Q15596 1/20 0.32
▸ NCOA1 Q15788 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ PBRM1 Q86U86 1/20 0.31
▸ TNKS2 Q9H2K2 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ IDO1 P14902 1/20 0.31
▸ METAP2 P50579 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ CASP3 P42574 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL27817087 0.75 P2RX7 (0.30) —
SCHEMBL28002690 0.66 LMNA (0.34) —
SCHEMBL28003002 0.66 CYP1A2 (0.30) ALDH1A1KDM4E
SCHEMBL28003039 0.65 KDM4E (0.36) ALDH1A1KDM4EGAAIDO1
SCHEMBL28002712 0.65 TAAR1 (0.35) RXFP1IDO1NPC1RAB9ASMN1; SMN2
SCHEMBL28003061 0.65 CYP2A6 (0.42) ALDH1A1KDM4EMETAP2SMN1; SMN2NISCH
SCHEMBL28714551 0.63 GAA (0.37) DCUN1D1ALDH1A1PBRM1TNKS2GAA
SCHEMBL25721326 0.61 TSHR (0.43) DCUN1D1ALDH1A1PKMKDM4EGAA
SCHEMBL197690 0.61 ACHE (0.64) DCUN1D1ALDH1A1GAAIDO1METAP2
SCHEMBL30354037 0.61 ACHE (0.64) DCUN1D1ALDH1A1GAAIDO1METAP2

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
CN-104411709-B Can be used as imidazo [2, the 1] thiazole-3-ketone derivatives of the diagnostic agent of Alzheimer 霍夫曼-拉罗奇有限公司 2016-08-24 — — CN disclosed
CN-104411709-A Imidazo [2,1]thiazol-3-one derivatives useful as diagnostic agents for alzheimer's disease HOFFMANN LA ROCHE 2015-03-11 — — CN disclosed
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