SCHEMBL29521131

SCHEMBL29521131

O=C(O)c1ccccc1SCC[Na].[Hg]

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.61
▸ RAB9A P51151 6/20 0.56
▸ POLB P06746 5/20 0.55
▸ NPC1 O15118 3/20 0.49
▸ GAA P10253 1/20 0.49
▸ HSP90AA1 P07900 1/20 0.49
▸ CA12 O43570 1/20 0.49
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ CA4 P22748 1/20 0.49
▸ CA7 P43166 1/20 0.49
▸ CA9 Q16790 1/20 0.49
▸ PTPRG P23470 1/20 0.48
▸ LPAR2 Q9HBW0 1/20 0.46
▸ LPAR3 Q9UBY5 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ ALDH1A1 P00352 4/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ LMNA P02545 2/20 0.44
▸ MAPT P10636 2/20 0.44

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
SCHEMBL7625298 1.00 CYP1A2 (0.61) CYP1A2RAB9APOLBNPC1GAA
SCHEMBL3389922 0.98 CYP1A2 (0.62) CYP1A2RAB9APOLBNPC1GAA
SCHEMBL6231914 0.87 CYP1A2 (0.71) CYP1A2RAB9APOLBNPC1GAA
SCHEMBL6231027 0.83 CYP1A2 (0.67) CYP1A2RAB9APOLBNPC1GAA
SCHEMBL6232508 0.83 CYP1A2 (0.67) CYP1A2RAB9APOLBNPC1GAA
SCHEMBL6232251 0.81 CYP1A2 (0.65) CYP1A2RAB9APOLBNPC1GAA
SCHEMBL6232914 0.81 CYP1A2 (0.65) CYP1A2RAB9APOLBNPC1GAA
SCHEMBL6234990 0.81 CYP1A2 (0.65) CYP1A2RAB9APOLBNPC1GAA
SCHEMBL9658167 0.81 CYP1A2 (0.65) CYP1A2RAB9APOLBNPC1GAA
SCHEMBL6234337 0.81 CYP1A2 (0.65) CYP1A2RAB9APOLBNPC1GAA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118267462-A Method for inoculating pigs to resist pseudorabies virus 硕腾服务有限责任公司 2024-07-02 — — CN disclosed
CN-116635521-A Attenuated porcine epidemic diarrhea virus 硕腾服务有限责任公司 2023-08-22 — — CN disclosed
CN-115216451-A Pseudorabies virus vaccine 硕腾服务有限责任公司 2022-10-21 — — CN disclosed
CN-114315985-A Attenuated porcine epidemic diarrhea virus 硕腾服务有限责任公司 2022-04-12 — — CN disclosed
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