SCHEMBL22460550

SCHEMBL22460550

COC(=O)C(CCCNC(=O)OC(C)(C)C)NC(=O)C(C)(C)OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.54
▸ KMT2A Q03164 5/20 0.54
▸ GAA P10253 1/20 0.54
▸ TDP1 Q9NUW8 7/20 0.46
▸ ATM Q13315 2/20 0.45
▸ NPSR1 Q6W5P4 5/20 0.43
▸ POLB P06746 3/20 0.43
▸ CA12 O43570 2/20 0.42
▸ CA1 P00915 2/20 0.42
▸ CA2 P00918 2/20 0.42
▸ CA9 Q16790 2/20 0.42
▸ MAPT P10636 3/20 0.41
▸ MAOA P21397 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ MMP1 P03956 1/20 0.40
▸ MMP3 P08254 1/20 0.40
▸ MMP9 P14780 1/20 0.40
▸ CTSS P25774 1/20 0.39
▸ CTSK P43235 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39

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
SCHEMBL22460551 1.00 MEN1 (0.54) MEN1KMT2AGAATDP1ATM
SCHEMBL21152479 0.96 TDP1 (0.49) MEN1KMT2AGAATDP1ATM
SCHEMBL24573412 0.91 KMT2A (0.50) MEN1KMT2AGAATDP1ATM
SCHEMBL25658967 0.88 TDP1 (0.47) MEN1KMT2AGAATDP1ATM
SCHEMBL30186579 0.88 MEN1 (0.60) MEN1KMT2AGAATDP1ATM
SCHEMBL22460384 0.87 MEN1 (0.51) MEN1KMT2AGAATDP1ATM
SCHEMBL19983086 0.84 MEN1 (0.47) MEN1KMT2AGAATDP1ATM
SCHEMBL5024804 0.83 MEN1 (0.55) MEN1KMT2AGAATDP1ATM
SCHEMBL24300318 0.83 TDP1 (0.52) MEN1KMT2AGAATDP1ATM
SCHEMBL30075862 0.83 TDP1 (0.49) MEN1KMT2AGAATDP1ATM

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
WO-2020191348-A1 ARGININE GINGIPAIN INHIBITORS Cortexyme, Inc. (US) 2020-09-24 — — WO disclosed
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