SCHEMBL8574576

SCHEMBL8574576

CCCC(=O)OCC1CCCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
SCN9A Q15858 1/20 0.45
GLS O94925 2/20 0.44
FEN1 P39748 2/20 0.43
ALOX5AP P20292 1/20 0.43
BACE1 P56817 2/20 0.42
ACKR3 P25106 1/20 0.42
CTSD P07339 1/20 0.42
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GLA P06280 1/20 0.42
RECQL P46063 1/20 0.42
HSD17B10 Q99714 1/20 0.42
KDM1A O60341 1/20 0.41
CHEK2 O96017 1/20 0.41
NR1H2 P55055 1/20 0.40
PDE4A P27815 1/20 0.39

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
SCHEMBL5191125 0.85 MEN1 (0.52) ALDH1A1MEN1MAPTKMT2ASCN9A
SCHEMBL5191130 0.84 MEN1 (0.51) ALDH1A1MEN1MAPTKMT2ASCN9A
SCHEMBL26501858 0.84 MEN1 (0.51) ALDH1A1MEN1MAPTKMT2ASCN9A
SCHEMBL22388103 0.83 MEN1 (0.50) ALDH1A1MEN1MAPTKMT2ASCN9A
SCHEMBL8719595 0.83 LMNA (0.45) ALDH1A1MEN1MAPTKMT2ACYP2C9
SCHEMBL8574640 0.83 LMNA (0.45) ALDH1A1MEN1MAPTKMT2ACYP2C9
SCHEMBL8577553 0.83 LMNA (0.45) ALDH1A1MEN1MAPTKMT2ACYP2C9
SCHEMBL22290470 0.83 MEN1 (0.54) ALDH1A1MEN1MAPTKMT2ASCN9A
SCHEMBL695894 0.83 MEN1 (0.54) ALDH1A1MEN1MAPTKMT2ASCN9A
SCHEMBL772145 0.83 MEN1 (0.54) ALDH1A1MEN1MAPTKMT2ASCN9A

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
US-5763436-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1998-06-09 US disclosed
US-5763604-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1998-06-09 US disclosed
US-5677448-A CHEMICAL INTERMEDIATES FOR MAKING ANTAGONIST OF THROMBIN, TREATING THROMBOSIS, STROKE, INFLAMMATION, ARTERIOSCLEROSIS, CARDIOVASCULAR DISORDERS HOFFMANN-LA ROCHE INC. (US) 1997-10-14 US disclosed
US-5595999-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1997-01-21 US disclosed
US-5583133-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1996-12-10 US disclosed
US-5578594-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1996-11-26 US disclosed
US-5532232-A INHIBIT THROMBIN INDUCED PLATELET AGGREGATION; FIBRINOGEN ANTICOAGULANTS IN BLOOD HOFFMANN-LA ROCHE INC. (US) 1996-07-02 US disclosed
US-5405854-A Anticoagulants HOFFMANN-LA ROCHE INC. (US) 1995-04-11 US disclosed
US-5393760-A Cardiovascular disorders, antitumor agents HOFFMANN-LA ROCHE INC. (US) 1995-02-28 US disclosed
US-5260307-A Inhibit thrombin-induced platlet aggregation and clotting of fibrogen in plasma HOFMANN-LA ROCHE INC. (US) 1993-11-09 US disclosed