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SCHEMBL4697341

SCHEMBL4697341

N=C(N)NCCC[C@H]1C(=O)N(C(=O)NCCc2ccccc2)[C@@H]1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TPSAB1 Q15661 11/20 0.58
▸ TPSD1 Q9BZJ3 11/20 0.58
▸ TPSG1 Q9NRR2 11/20 0.58
▸ ASAH1 Q13510 5/20 0.45
▸ EPHX2 P34913 2/20 0.38
▸ NAMPT P43490 1/20 0.38
▸ P2RX4 Q99571 1/20 0.38

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
SCHEMBL4697345 1.00 TPSAB1 (0.58) TPSAB1TPSD1TPSG1ASAH1EPHX2
SCHEMBL3338948 0.88 TPSAB1 (0.46) TPSAB1TPSD1TPSG1ASAH1P2RX4
SCHEMBL4697644 0.86 TPSAB1 (0.50) TPSAB1TPSD1TPSG1
SCHEMBL3335469 0.85 TPSAB1 (0.68) TPSAB1TPSD1TPSG1
SCHEMBL3332397 0.85 TPSAB1 (0.68) TPSAB1TPSD1TPSG1
SCHEMBL4697607 0.83 TPSAB1 (0.48) TPSAB1TPSD1TPSG1ASAH1P2RX4
SCHEMBL3333854 0.81 TPSAB1 (0.48) TPSAB1TPSD1TPSG1EPHX2
SCHEMBL3336687 0.81 TPSAB1 (0.48) TPSAB1TPSD1TPSG1EPHX2
SCHEMBL3333102 0.79 TPSAB1 (0.53) TPSAB1TPSD1TPSG1
SCHEMBL3333866 0.79 TPSAB1 (0.56) TPSAB1TPSD1TPSG1

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
EP-1871741-A2 SUBSTITUTED AZETIDINONES Daiamed, Inc. (US) 2008-01-02 — — EP disclosed
WO-2006108039-A2 SUBSTITUTED AZETIDINONES DAIAMED, INC. (US) 2006-10-12 — — WO disclosed