SCHEMBL2768085

SCHEMBL2768085

CCN(CC)CCC1CCCCN1C(=O)c1ccc(N2CC(NC(=O)Oc3ccc(Br)s3)CC2=O)cc1C

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.40
POLB P06746 3/20 0.40
MAPT P10636 1/20 0.36
TP53 P04637 5/20 0.35
HPGD P15428 1/20 0.33

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
SCHEMBL2765232 0.91 POLB (0.43) LMNAPOLBMAPTTP53HPGD
SCHEMBL2766932 0.90 LMNA (0.40) LMNAPOLBMAPTTP53
SCHEMBL2766998 0.90 LMNA (0.42) LMNAPOLBMAPTTP53
SCHEMBL2767884 0.90 LMNA (0.39) LMNAPOLBMAPTTP53
SCHEMBL2768204 0.90 LMNA (0.40) LMNAPOLBMAPTTP53HPGD
SCHEMBL2768167 0.90 LMNA (0.41) LMNAPOLBMAPTTP53
SCHEMBL3286686 0.89 LMNA (0.41) LMNAPOLBTP53HPGD
SCHEMBL2766127 0.89 LMNA (0.43) LMNAPOLBMAPTTP53
SCHEMBL2766953 0.88 LMNA (0.41) LMNAPOLBMAPTTP53
SCHEMBL2768166 0.87 LMNA (0.44) LMNAPOLBMAPTTP53

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-1858890-B1 NOVEL ANTITHROMBOTIC SUBSTITUTED PYRROLIDINONES, THE PRODUCTION AND USE THEREOF IN THE FORM OF MEDICAMENTS BOEHRINGER INGELHEIM PHARMA (DE) 2010-04-14 EP disclosed
EP-1858890-A1 NOVEL ANTITHROMBOTIC SUBSTITUTED PYRROLIDINONES, THE PRODUCTION AND USE THEREOF IN THE FORM OF MEDICAMENTS Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2007-11-28 EP disclosed
WO-2006089909-A1 NOVEL ANTITHROMBOTIC SUBSTITUTED PYRROLIDINONES, THE PRODUCTION AND USE THEREOF IN THE FORM OF MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-08-31 WO disclosed