SCHEMBL5400405

SCHEMBL5400405

C[C@H](N)C(=O)NCc1cc2ccccc2oc1=O

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 8/20 0.55
▸ MAOA P21397 3/20 0.55
▸ MMP2 P08253 1/20 0.51
▸ MMP9 P14780 1/20 0.51
▸ ADAM17 P78536 1/20 0.51
▸ NPC1 O15118 3/20 0.49
▸ KMT2A Q03164 3/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ TP53 P04637 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ HPGD P15428 1/20 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
SCHEMBL5400401 1.00 MAOB (0.55) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL16401469 0.91 MAOB (0.49) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL6930389 0.90 MAOB (0.53) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL2383875 0.83 MEN1 (0.47) MAOBMAOAADAM17NPC1KMT2A
SCHEMBL4416398 0.80 MAOB (0.43) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL4416405 0.80 MAOB (0.43) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL4796989 0.79 MAOB (0.46) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL12493203 0.79 MAOB (0.46) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL5614017 0.78 MAOB (0.41) MAOBMAOAMMP2MMP9ADAM17
SCHEMBL5294818 0.76 ADAM17 (0.73) MAOBMAOAMMP2MMP9ADAM17

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
US-7217536-B2 Medium and method for detecting/identifying microorganisms BIO MERIEUX (FR) 2007-05-15 — — US disclosed
US-20050014215-A1 Method and medium for the detecting/identifying microorganisms with esterase and/or r osidase and/or peptidase and/or sulfatase and/or phosphatase activity BIO MERIEUX (FR) 2005-01-20 — — US disclosed
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