SCHEMBL7286972

SCHEMBL7286972

CCCC[C@H](NC(=O)CC(Cc1cccc2ccccc12)OS(=O)(=O)c1ccc(C)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSMB8 P28062 1/20 0.40
▸ PSMB5 P28074 1/20 0.40
▸ CTSK P43235 2/20 0.39
▸ CTSS P25774 1/20 0.39
▸ REN P00797 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ TACR1 P25103 1/20 0.39
▸ PLAU P00749 1/20 0.36
▸ HPN P05981 1/20 0.36
▸ MMP9 P14780 1/20 0.35
▸ ACE P12821 2/20 0.35
▸ NR3C1 P04150 1/20 0.35
▸ PGR P06401 1/20 0.35
▸ NR3C2 P08235 1/20 0.35
▸ MME P08473 1/20 0.35
▸ CPA1 P15085 1/20 0.35
▸ ACE2 Q9BYF1 1/20 0.35
▸ MMP1 P03956 1/20 0.35
▸ MMP7 P09237 1/20 0.35

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
SCHEMBL7267650 0.82 REN (0.43) PSMB8PSMB5CTSKCTSSREN
SCHEMBL9418001 0.78 CTSK (0.42) CTSKCTSSRENTACR1ACE
SCHEMBL7269124 0.77 REN (0.41) PSMB8PSMB5CTSKCTSSREN
SCHEMBL7269128 0.77 REN (0.41) PSMB8PSMB5CTSKCTSSREN
SCHEMBL7266649 0.75 CTSK (0.48) CTSKCTSSTACR1MMP9ACE
SCHEMBL7268860 0.74 CTSK (0.42) CTSKCTSSRENTACR1MMP9
SCHEMBL7288315 0.74 CTSK (0.48) CTSKCTSSRENTACR1MMP9
SCHEMBL7267189 0.74 CTSK (0.48) CTSKCTSSRENTACR1MMP9
SCHEMBL7267552 0.74 CTSK (0.45) CTSKCTSSRENMMP9ACE
SCHEMBL7267197 0.73 CTSK (0.44) CTSKCTSSRENMMP9ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5506356-A RENIN INHIBITORS; HYPOTENSIVE AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1996-04-09 — — US disclosed
US-5481036-A RENIN INHIBITORS, HYPOTENSIVE AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1996-01-02 — — US disclosed
US-5240924-A Dipeptide hypotensives BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-08-31 — — US disclosed
US-5122523-A Hypotensive agents BANYU PHARMACEUTICAL CO., LTD. (JP) 1992-06-16 — — US disclosed
EP-0309766-A2 N-acylamino acid derivatives and their use BANYU PHARMACEUTICAL CO., LTD. (JP) 1989-04-05 — — EP disclosed
Send feedback