SCHEMBL9816924

SCHEMBL9816924

CCOc1ccc(CC(NC(=O)[C@H](CCSC)NC(C)=O)C(=O)O)cc1OCC

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DRD1 P21728 1/20 0.54
▸ PTPN1 P18031 4/20 0.50
▸ LMNA P02545 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ BACE1 P56817 2/20 0.42
▸ LTA4H P09960 1/20 0.41
▸ ITGB3 P05106 1/20 0.41
▸ ITGA2B P08514 1/20 0.41
▸ GNPAT O15228 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ PTPN2 P17706 3/20 0.41
▸ PTPRA P18433 1/20 0.41
▸ BACE2 Q9Y5Z0 1/20 0.41

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
SCHEMBL9816930 1.00 DRD1 (0.54) DRD1PTPN1LMNAATMBACE1
SCHEMBL9816922 0.88 ATM (0.53) DRD1PTPN1LMNAATMBACE1
SCHEMBL9816929 0.88 ATM (0.53) DRD1PTPN1LMNAATMBACE1
SCHEMBL7290024 0.87 ITGB3 (0.51) LMNAITGB3ITGA2BALDH1A1NPSR1
SCHEMBL7290022 0.87 ITGB3 (0.51) LMNAITGB3ITGA2BALDH1A1NPSR1
SCHEMBL9816890 0.83 MME (0.44) PTPN1ITGB3ITGA2B
SCHEMBL9816898 0.83 MME (0.44) PTPN1ITGB3ITGA2B
SCHEMBL11457694 0.81 MEN1 (0.50) PTPN1ITGB3ITGA2B
SCHEMBL8836882 0.80 GNPAT (0.61) PTPN1BACE1LTA4HGNPATBACE2
SCHEMBL11458383 0.79 PTPN1 (0.49) PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0106335-B1 PHARMACEUTICAL COMPOSITION AND A METHOD FOR ENHANCING THE ABSORPTION OF A PHARMACEUTICALLY ACTIVE COMPOUND Tanabe Seiyaku Co., Ltd. (JP) 1991-10-23 — — EP claimed
EP-0106335-A2 Pharmaceutical composition and a method for enhancing the absorption of a pharmaceutically active compound Tanabe Seiyaku Co., Ltd. (JP) 1984-04-25 — — EP claimed
EP-0106335-B1 PHARMACEUTICAL COMPOSITION AND A METHOD FOR ENHANCING THE ABSORPTION OF A PHARMACEUTICALLY ACTIVE COMPOUND Tanabe Seiyaku Co., Ltd. (JP) 1991-10-23 — — EP disclosed
EP-0106335-A2 Pharmaceutical composition and a method for enhancing the absorption of a pharmaceutically active compound Tanabe Seiyaku Co., Ltd. (JP) 1984-04-25 — — EP disclosed
US-4228183-A HYPOTENSIVE AGENTS TANABE SEIYAKU CO., LTD. (JP) 1980-10-14 — — US disclosed
EP-0007441-A1 N - (N-Acetyl-L-methionyl) - 3,4 -diethoxy-carbonyloxy-phenethylamine, process for preparing same and a pharmaceutical composition containing said compound. Tanabe Seiyaku Co., Ltd. (JP) 1980-02-06 — — EP disclosed
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