SCHEMBL29963045

SCHEMBL29963045

O=C(CS)NCCc1ccc(O)c(O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.66
▸ HSD17B10 Q99714 4/20 0.66
▸ KDM4E B2RXH2 4/20 0.66
▸ ALDH1A1 P00352 4/20 0.66
▸ HPGD P15428 4/20 0.66
▸ HIF1A Q16665 3/20 0.66
▸ LMNA P02545 3/20 0.66
▸ BLM P54132 3/20 0.66
▸ PTGS1 P23219 1/20 0.66
▸ TRPV1 Q8NER1 4/20 0.61
▸ MEN1 O00255 3/20 0.61
▸ KMT2A Q03164 3/20 0.61
▸ ERCC1 P07992 1/20 0.61
▸ ERCC4 Q92889 1/20 0.61
▸ GAA P10253 2/20 0.59
▸ POLB P06746 2/20 0.58
▸ PKM P14618 1/20 0.58
▸ HTT P42858 1/20 0.58
▸ ALOX12 P18054 2/20 0.56
▸ APP P05067 1/20 0.55

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
SCHEMBL15933030 1.00 MAPT (0.66) MAPTHSD17B10KDM4EALDH1A1HPGD
SCHEMBL109158 0.86 MAPT (0.73) MAPTHSD17B10KDM4EALDH1A1HPGD
SCHEMBL107219 0.85 MAPT (0.71) MAPTHSD17B10KDM4EALDH1A1HPGD
SCHEMBL2266963 0.85 MAPT (0.68) MAPTHSD17B10KDM4EALDH1A1HPGD
SCHEMBL109104 0.85 MAPT (0.68) MAPTHSD17B10KDM4EALDH1A1HPGD
SCHEMBL24649660 0.84 MAPT (0.71) MAPTHSD17B10KDM4EALDH1A1HPGD
SCHEMBL12972260 0.83 MAPT (0.66) MAPTHSD17B10KDM4EALDH1A1HPGD
SCHEMBL17205984 0.83 MAPT (0.71) MAPTHSD17B10KDM4EALDH1A1HPGD
SCHEMBL28976197 0.83 MAPT (0.66) MAPTHSD17B10KDM4EALDH1A1HPGD
SCHEMBL7105545 0.82 MAPT (0.74) MAPTHSD17B10KDM4EALDH1A1HPGD

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-115137880-B Medical equipment with coating 业聚医疗私人有限公司 2024-05-03 — — CN disclosed
CN-115137880-A Medical equipment with coating 祥丰医疗私人有限公司 2022-10-04 — — CN disclosed
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