SCHEMBL11500430

SCHEMBL11500430

CCN1CCN(C(=O)NCC(=O)NC(C(=O)NC2CNC2=O)c2ccccc2)C(=O)C1=O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ ATM Q13315 1/20 0.44
▸ CCKBR P32239 1/20 0.39
▸ MAPT P10636 1/20 0.38
▸ PDE3A Q14432 1/20 0.38
▸ SLC22A6 Q4U2R8 1/20 0.38
▸ SLC22A8 Q8TCC7 1/20 0.38
▸ SLC22A11 Q9NSA0 1/20 0.38
▸ THRB P10828 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ CTSL P07711 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.36
▸ NAAA Q02083 4/20 0.34

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
SCHEMBL10695608 0.91 MEN1 (0.46) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL11404293 0.84 MEN1 (0.38) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10545315 0.83 MAPT (0.50) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL11405493 0.82 CTSL (0.55) CTSLNAAA
SCHEMBL10545391 0.82 MAPT (0.43) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10546201 0.81 MEN1 (0.43) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10765931 0.81 MAPT (0.41) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10547403 0.81 MAPT (0.44) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10545073 0.81 MEN1 (0.42) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL11065314 0.81 MEN1 (0.42) MEN1KMT2ACCKBRMAPTPDE3A

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-0021678-A1 1-Sulpho-2-oxoazetidine derivatives, their production and pharmaceutical compositions thereof Takeda Chemical Industries, Ltd. (JP) 1981-01-07 — — EP disclosed
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