SCHEMBL28432641

SCHEMBL28432641

CN(C)CCc1cc2ccccc2oc1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 1/20 0.56
▸ MMP9 P14780 1/20 0.56
▸ ADAM17 P78536 1/20 0.56
▸ KDM4E B2RXH2 3/20 0.54
▸ ALDH1A1 P00352 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ MAOB P27338 6/20 0.54
▸ MAOA P21397 3/20 0.54
▸ TYR P14679 1/20 0.47
▸ DAO P14920 1/20 0.47
▸ AKR1B1 P15121 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ CA12 O43570 2/20 0.46
▸ CA9 Q16790 2/20 0.46

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
SCHEMBL27625488 0.85 MMP2 (0.67) MMP2MMP9ADAM17KDM4EALDH1A1
SCHEMBL15065807 0.84 MAOB (0.56) MMP2MMP9ADAM17KDM4EALDH1A1
SCHEMBL11092927 0.82 MAOB (0.66) MMP2MMP9ADAM17KDM4EALDH1A1
SCHEMBL30594160 0.80 MAOB (0.67) MMP2MMP9ADAM17KDM4EALDH1A1
SCHEMBL1619109 0.80 MAOB (0.67) MMP2MMP9ADAM17KDM4EALDH1A1
SCHEMBL3506842 0.79 MAOB (0.62) MMP2MMP9ADAM17KDM4EALDH1A1
SCHEMBL4927452 0.79 MMP2 (0.64) MMP2MMP9ADAM17KDM4EALDH1A1
SCHEMBL31320649 0.79 MMP2 (0.64) MMP2MMP9ADAM17KDM4EALDH1A1
SCHEMBL4390620 0.79 MMP2 (0.60) MMP2MMP9ADAM17KDM4EALDH1A1
SCHEMBL293739 0.79 MMP2 (0.60) MMP2MMP9ADAM17KDM4EALDH1A1

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-111050688-B Waste disposal system and waste receptacle for receiving and disposing of pharmaceutical waste 史赛克公司 2023-05-09 — — CN disclosed
CN-111050688-A Waste disposal system and waste receptacle for receiving and disposing of pharmaceutical waste 史赛克公司 2020-04-21 — — CN disclosed
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