SCHEMBL9358845

SCHEMBL9358845

COC[C@@H]1CCCN1C(=O)OC(Cc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PREP P48147 6/20 0.47
▸ ACE2 Q9BYF1 3/20 0.46
▸ CTRB1 P17538 1/20 0.46
▸ ATM Q13315 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ CHRNB2 P17787 1/20 0.43
▸ CHRNA5 P30532 1/20 0.43
▸ CHRNA7 P36544 1/20 0.43
▸ CHRNA4 P43681 1/20 0.43
▸ FKBP1A P62942 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ ACE P12821 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
SCHEMBL9358850 1.00 PREP (0.47) PREPACE2CTRB1ATML3MBTL1
SCHEMBL9354968 0.89 ATM (0.45) PREPACE2ATML3MBTL1ACE
SCHEMBL9354974 0.89 ATM (0.45) PREPACE2ATML3MBTL1ACE
SCHEMBL9354526 0.88 SPHK2 (0.52) PREPACE2CTRB1ATML3MBTL1
SCHEMBL9354523 0.88 SPHK2 (0.52) PREPACE2CTRB1ATML3MBTL1
SCHEMBL9358285 0.88 SPHK2 (0.52) PREPACE2CTRB1ATML3MBTL1
SCHEMBL13994810 0.85 PREP (0.57) PREPACE2L3MBTL1NPSR1KDM4E
SCHEMBL791439 0.85 PREP (0.57) PREPACE2L3MBTL1NPSR1KDM4E
SCHEMBL9354348 0.83 FKBP1A (0.55) PREPCTRB1L3MBTL1FKBP1ANPSR1
SCHEMBL9354721 0.83 FKBP1A (0.55) PREPCTRB1L3MBTL1FKBP1ANPSR1

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
EP-0300189-B1 New amino acid derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1994-11-02 — — EP disclosed
US-5223489-A Treatment of ypertension and heart failure UJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-06-29 — — US disclosed
US-5142048-A Enzyme inhibitor; carbamoyl group-containing acids FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-08-25 — — US disclosed
US-4921855-A New Histidyl amino acid derivatives, and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-05-01 — — US disclosed
EP-0300189-A2 New amino acid derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-01-25 — — EP disclosed
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