SCHEMBL9358849

SCHEMBL9358849

O=C(O)[C@H](Cc1ccccc1)OC(=O)N1CCC[C@@H]1CO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SPHK2 Q9NRA0 1/20 0.50
▸ POLB P06746 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ ACE P12821 2/20 0.44
▸ SRR Q9GZT4 2/20 0.43
▸ ACE2 Q9BYF1 1/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ DPP4 P27487 2/20 0.43
▸ DPP8 Q6V1X1 2/20 0.43
▸ DPP9 Q86TI2 2/20 0.43
▸ DPP7 Q9UHL4 2/20 0.43
▸ FAP Q12884 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ LTA4H P09960 2/20 0.42
▸ PPARG P37231 2/20 0.42
▸ PPARA Q07869 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ CTRB1 P17538 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
SCHEMBL9354505 1.00 SPHK2 (0.50) SPHK2POLBMEN1KMT2AACE
SCHEMBL9354495 1.00 SPHK2 (0.50) SPHK2POLBMEN1KMT2AACE
SCHEMBL9354523 0.89 SPHK2 (0.52) SPHK2KMT2AACEACE2L3MBTL1
SCHEMBL9354526 0.89 SPHK2 (0.52) SPHK2KMT2AACEACE2L3MBTL1
SCHEMBL9358285 0.89 SPHK2 (0.52) SPHK2KMT2AACEACE2L3MBTL1
SCHEMBL9354974 0.87 ATM (0.45) MEN1KMT2AACESRRACE2
SCHEMBL9354968 0.87 ATM (0.45) MEN1KMT2AACESRRACE2
SCHEMBL9354431 0.80 ACE (0.55) ACELTA4HALDH1A1CTRB1
SCHEMBL9354429 0.80 ACE (0.55) ACELTA4HALDH1A1CTRB1
SCHEMBL9354783 0.80 ACE (0.55) ACELTA4HALDH1A1CTRB1

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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