SCHEMBL10678087

SCHEMBL10678087

CCN1CCN(C(=O)NC(C(=O)N[C@@H]2C(=O)N(OCC(=O)O)[C@H]2C)c2ccccc2)C(=O)C1=O.[NaH]

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ CCKBR P32239 1/20 0.45
▸ MAPT P10636 1/20 0.42
▸ PDE3A Q14432 1/20 0.42
▸ SLC22A6 Q4U2R8 1/20 0.42
▸ SLC22A8 Q8TCC7 1/20 0.42
▸ SLC22A11 Q9NSA0 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ THRB P10828 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ CA1 P00915 5/20 0.33
▸ CA2 P00918 5/20 0.33
▸ NAAA Q02083 1/20 0.33
▸ GPR88 Q9GZN0 3/20 0.32
▸ CTSS P25774 1/20 0.31
▸ CTSK P43235 1/20 0.31

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
SCHEMBL10678091 0.92 LMNA (0.46) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10966530 0.90 MEN1 (0.45) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10966533 0.90 MEN1 (0.45) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10999445 0.89 MEN1 (0.44) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10988836 0.89 MEN1 (0.44) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10415564 0.89 MEN1 (0.47) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10981010 0.86 MEN1 (0.45) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10735752 0.85 MEN1 (0.47) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10735772 0.85 MEN1 (0.47) MEN1KMT2ACCKBRMAPTPDE3A
SCHEMBL10678182 0.83 MEN1 (0.41) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4794108-A BACTERICIDES, MICROBIOCIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-12-27 — — US disclosed
EP-0135194-A1 Azetidinones and their production Takeda Chemical Industries, Ltd. (JP) 1985-03-27 — — EP disclosed
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