SCHEMBL29015734

SCHEMBL29015734

Cn1c(=O)[nH]cc(S)c1=O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 2/20 0.37
▸ ADORA2B P29275 2/20 0.37
▸ ADORA3 P0DMS8 1/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ PMP22 Q01453 1/20 0.33
▸ CRBN Q96SW2 1/20 0.32
▸ APAF1 O14727 1/20 0.32
▸ CASP6 P55212 1/20 0.32
▸ ATAD2 Q6PL18 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
SCHEMBL221825 0.76 SLC9A1 (0.41) ADORA2AADORA2BADORA3ADORA1ALDH1A1
SCHEMBL16652006 0.74 ADORA2A (0.36) ADORA2AADORA2BADORA3ADORA1ALDH1A1
SCHEMBL11480635 0.74 ADORA2A (0.36) ADORA2AADORA2BADORA3ADORA1ALDH1A1
SCHEMBL25979874 0.74 ADORA2A (0.36) ADORA2AADORA2BADORA3ADORA1ALDH1A1
SCHEMBL2078821 0.74 ADORA2A (0.36) ADORA2AADORA2BADORA3ADORA1ALDH1A1
SCHEMBL13469216 0.73 ADORA2A (0.35) ADORA2AADORA2BADORA3ADORA1ALDH1A1
SCHEMBL17372113 0.71 KDM4E (0.37) ADORA2AADORA2BALDH1A1LMNAMAPT
SCHEMBL2490716 0.71 ADORA2A (0.38) ADORA2AADORA2BADORA3ADORA1ALDH1A1
SCHEMBL15614498 0.71 ADORA2B (0.34) ADORA2AADORA2BADORA3ADORA1ALDH1A1
SCHEMBL17351674 0.71 ADORA2A (0.36) ADORA2AADORA2BADORA3ADORA1ALDH1A1

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-108341951-B Dynamic polymer with hybrid cross-linked structure and application thereof 厦门天策材料科技有限公司 2023-06-20 — — CN disclosed
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