SCHEMBL2767520

SCHEMBL2767520

COC[C@H]1CCCN1C(=O)c1ccc(N2CC(NC(=O)Oc3ccc(Br)s3)CC2=O)cc1C

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
POLB P06746 1/20 0.41
HTR7 P34969 1/20 0.38
TP53 P04637 4/20 0.36
KCNK3 O14649 2/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL2767030 1.00 LMNA (0.41) LMNAPOLBHTR7TP53KCNK3
SCHEMBL2766198 0.92 LMNA (0.42) LMNAPOLBTP53MAPT
SCHEMBL2765602 0.92 LMNA (0.42) LMNAPOLBTP53MAPT
SCHEMBL2768238 0.92 LMNA (0.42) LMNAPOLBTP53MAPT
SCHEMBL2765621 0.90 LMNA (0.41) LMNAPOLBTP53
SCHEMBL2766628 0.90 LMNA (0.41) LMNAPOLBTP53
SCHEMBL2766953 0.90 LMNA (0.41) LMNAPOLBTP53MAPT
SCHEMBL2765232 0.90 POLB (0.43) LMNAPOLBTP53MAPT
SCHEMBL2766127 0.90 LMNA (0.43) LMNAPOLBTP53MAPT
SCHEMBL3287412 0.89 TP53 (0.42) LMNAPOLBHTR7TP53

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 1 patent. 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