SCHEMBL23367183

SCHEMBL23367183

C=C(N)C(CNC(=O)OC(C)(C)C)(NC(C)=O)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
CA1 P00915 4/20 0.35
CA2 P00918 4/20 0.35
CA7 P43166 1/20 0.35
CTSS P25774 3/20 0.33
CTSK P43235 3/20 0.33
CA12 O43570 4/20 0.33
CA9 Q16790 3/20 0.33
CA14 Q9ULX7 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
CYP2D6 P10635 1/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL23366836 0.81 MAOA (0.40) MAOAMAOBMEN1GAAKMT2A
SCHEMBL23367181 0.75 PIK3CD (0.32) TDP1
SCHEMBL7271807 0.74 KMT2A (0.45) MAOAMAOBMEN1GAAKMT2A
SCHEMBL23366824 0.74 TDP1 (0.40) MAOAMAOBMEN1GAAKMT2A
SCHEMBL23366875 0.74 EPHX1 (0.36) MAOAMAOBMEN1GAAKMT2A
SCHEMBL23367530 0.74 TSHR (0.32) TDP1LMNATSHRNFKB1
SCHEMBL842921 0.70 TDP1 (0.52) MAOAMAOBMEN1GAAKMT2A
SCHEMBL8267374 0.69 TDP1 (0.47) MAOAMAOBMEN1GAAKMT2A
SCHEMBL22624247 0.69 MEN1 (0.49) MAOAMAOBMEN1GAAKMT2A
SCHEMBL23367211 0.69 EPHX1 (0.39) MAOAMAOBMEN1GAAKMT2A

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
EP-3822265-A1 SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS Bayer AG (DE) 2021-05-19 EP disclosed