SCHEMBL8041384

SCHEMBL8041384

CC(C)(C)OC(=O)NCC(=O)NCc1nccs1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
METAP1 P53582 1/20 0.42
CTSK P43235 1/20 0.40
NTRK1 P04629 1/20 0.39
CYP3A4 P08684 1/20 0.38
PKM P14618 2/20 0.38
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HDAC3 O15379 3/20 0.37
HDAC1 Q13547 3/20 0.37
HDAC6 Q9UBN7 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ADORA2A P29274 1/20 0.36
EGFR P00533 1/20 0.36
RAF1 P04049 1/20 0.36

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
SCHEMBL1585659 0.90 L3MBTL1 (0.47) L3MBTL1METAP1CTSKPKMALDH1A1
SCHEMBL3654698 0.80 L3MBTL1 (0.47) L3MBTL1METAP1ALDH1A1MEN1KMT2A
SCHEMBL8332495 0.80 METAP1 (0.42) L3MBTL1METAP1CTSKNTRK1CYP3A4
SCHEMBL21743808 0.80 L3MBTL1 (0.51) L3MBTL1CYP3A4HDAC3HDAC1HDAC6
SCHEMBL3564269 0.80 L3MBTL1 (0.48) L3MBTL1METAP1CTSKCYP3A4MEN1
SCHEMBL8053475 0.79 CTSK (0.44) L3MBTL1METAP1CTSKKMT2A
SCHEMBL8059229 0.79 POLB (0.39) CTSKNTRK1PKMALDH1A1MEN1
SCHEMBL8052935 0.79 CTSK (0.44) L3MBTL1METAP1CTSKKMT2A
SCHEMBL28231828 0.77 L3MBTL1 (0.51) L3MBTL1METAP1CYP3A4MEN1KMT2A
SCHEMBL8053811 0.77 MAPT (0.42) CTSKNTRK1PKMALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0669336-B1 NOVEL CEPHEM DERIVATIVES MEIJI SEIKA CO (JP) 2000-05-17 EP disclosed
US-5663162-A BACTERICIDES AND ANTIBIOTICS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-09-02 US disclosed
EP-0669336-A1 NOVEL CEPHEM DERIVATIVE MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-08-30 EP disclosed