SCHEMBL8608071

SCHEMBL8608071

O=C(O)CCC1CCN(CC(=O)O)CC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.44
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43
ITGB3 P05106 4/20 0.41
ITGA2B P08514 4/20 0.41
LTA4H P09960 1/20 0.40
ICAM1 P05362 1/20 0.38
HTT P42858 1/20 0.37
RECQL P46063 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
F2R P25116 2/20 0.37
HSD11B1 P28845 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
SCHEMBL26349586 0.86 PAOX (0.37) HSD17B10BCHEACHEITGB3ITGA2B
SCHEMBL7359289 0.84 HSD17B10 (0.44) HSD17B10BCHEACHEITGB3ITGA2B
SCHEMBL11155988 0.84 GLA (0.50) BCHEACHEITGB3ITGA2BLTA4H
SCHEMBL7062260 0.83 SMN1; SMN2 (0.42) BCHEACHEITGB3ITGA2BLTA4H
SCHEMBL18930342 0.82 HSD11B1 (0.54) BCHEACHEITGB3ITGA2BLTA4H
SCHEMBL30312994 0.80 BCHE (0.36) HSD17B10BCHEACHEHTTHSD11B1
SCHEMBL24709214 0.80 HTR4 (0.40) BCHEACHEITGB3ITGA2BLTA4H
SCHEMBL7060631 0.80 GSK3B (0.39) BCHEACHELTA4HHSD11B1
SCHEMBL20366141 0.79 PRMT3 (0.46) BCHEACHEITGB3ITGA2BLTA4H
SCHEMBL24754066 0.79 MAPT (0.47) HSD17B10HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0637318-B1 PEPTIDE DERIVATIVES CORRESPONDING TO THE CARBOXY TERMINAL SEQUENCE OF HIRUDIN CIBA GEIGY AG (CH) 1998-04-01 EP disclosed
US-5686564-A Peptide derivatives corresponding to the carboxy terminal sequence of hirudin NOVARTIS CORPORATION (US) 1997-11-11 US disclosed
EP-0637318-A1 PEPTIDE DERIVATIVES CORRESPONDING TO THE CARBOXY TERMINAL SEQUENCE OF HIRUDIN Novartis AG (CH) 1995-02-08 EP disclosed
WO-1993022344-A1 PEPTIDE DERIVATIVES CORRESPONDING TO THE CARBOXY TERMINAL SEQUENCE OF HIRUDIN CIBA-GEIGY AG (CH) 1993-11-11 WO disclosed