SCHEMBL7207942

SCHEMBL7207942

CC(=O)N[C@@H](CC1CCCCC1)C(=O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
REN P00797 1/20 0.44
GRN P28799 1/20 0.43
SORT1 Q99523 1/20 0.43
CTSK P43235 4/20 0.42
CTSS P25774 2/20 0.42
CTSL P07711 2/20 0.41
CTSB P07858 1/20 0.41
F2 P00734 2/20 0.40
LTA4H P09960 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
CPB2 Q96IY4 6/20 0.39
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
ALOX15 P16050 1/20 0.38
NFKB1 P19838 1/20 0.38
PTGS2 P35354 1/20 0.38
THPO P40225 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38

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
SCHEMBL29511128 0.86 GRN (0.55) RENGRNSORT1CTSKCTSS
SCHEMBL7843875 0.86 GRN (0.55) RENGRNSORT1CTSKCTSS
SCHEMBL6467188 0.86 GRN (0.55) RENGRNSORT1CTSKCTSS
SCHEMBL20994281 0.84 GRN (0.52) RENGRNSORT1CTSKCTSS
SCHEMBL20994283 0.84 GRN (0.52) RENGRNSORT1CTSKCTSS
SCHEMBL13038259 0.83 GRN (0.41) GRNSORT1CTSKCTSSCTSL
SCHEMBL13672872 0.83 GRN (0.41) GRNSORT1CTSKCTSSCTSL
SCHEMBL8229203 0.81 CTSK (0.43) GRNSORT1CTSKCTSSCTSL
SCHEMBL23052492 0.80 REN (0.44) RENGRNSORT1CTSKCTSS
SCHEMBL19270372 0.80 MMP1 (0.51) RENCTSKCTSSCTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934923-B1 OPTICALLY ACTIVE ERYTHRO-3-AMINO-2-HYDROXYBUTYRIC ESTERS AND PROCESS FOR PREPARING SAID ESTERS NIPPON KAYAKU KK (JP) 2003-04-02 EP disclosed
US-6063955-A OXIDIZING A THREO OR THREO-ERYTHRO-3-AMINO-2-HYDROXYBUTYRIC ACID ESTER, OPTICALLY ACTIVE AT 3-POSITION TO PRODUCE AN OPTICALLY ACTIVE 3-AMINO-2-OXOBUTYRIC ESTER, REDUCING ERYTHRO-SELECTIVELY CARBONYL GROUP AT 2-POSITION NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2000-05-16 US disclosed
EP-0934923-A1 OPTICALLY ACTIVE ERYTHRO-3-AMINO-2-HYDROXYBUTYRIC ESTERS AND PROCESS FOR PREPARING SAID ESTERS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1999-08-11 EP disclosed