SCHEMBL7274362

SCHEMBL7274362

CCOC(=O)C(CC)(C(CC)c1cccc2ccccc12)P(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
ACP3 P15309 4/20 0.39
CDC25B P30305 2/20 0.39
THRB P10828 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CTSG P08311 1/20 0.37
CMA1 P23946 1/20 0.37
CDC25A P30304 1/20 0.37
CDC25C P30307 1/20 0.37

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
SCHEMBL7266108 0.82 OPRD1 (0.36) ALDH1A1
SCHEMBL7273220 0.82 KDM4E (0.42) ALDH1A1HPGDL3MBTL1
SCHEMBL7266768 0.80 PIN1 (0.41) ALDH1A1
SCHEMBL283095 0.73 ALDH1A1 (0.50) ALDH1A1HPGDCDC25BCDC25ACDC25C
SCHEMBL7415253 0.71 PIN1 (0.42) ALDH1A1
SCHEMBL28480579 0.70 ALDH1A1 (0.50) ALDH1A1HPGDCDC25BL3MBTL1CDC25A
SCHEMBL6779155 0.70 SMN1; SMN2 (0.39) ALDH1A1
SCHEMBL1433197 0.70 ALDH1A1 (0.53) ALDH1A1HPGDCDC25BL3MBTL1CDC25A
SCHEMBL3889930 0.69 MMP8 (0.37) ALDH1A1THRBL3MBTL1
SCHEMBL6784316 0.69 SMN1; SMN2 (0.43) ALDH1A1ACP3THRBL3MBTL1CTSG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0309766-B1 N-acylamino acid derivatives and their use BANYU PHARMA CO LTD (JP) 1998-04-15 EP disclosed
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
EP-0377139-B1 N-substituted acylamino acid compounds, process for their production and their use BANYU PHARMA CO LTD (JP) 1995-07-12 EP disclosed
US-5424309-A Hypotensive agents BANYU PHARMACEUTICAL CO., LTD. (JP) 1995-06-13 US disclosed
US-5319082-A N-acylamino acid derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1994-06-07 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-0377139-A1 N-substituted acylamino acid compounds, process for their production and their use Banyu Pharmaceutical Co., Ltd. (JP) 1990-07-11 EP disclosed
EP-0309766-A2 N-acylamino acid derivatives and their use BANYU PHARMACEUTICAL CO., LTD. (JP) 1989-04-05 EP disclosed