SCHEMBL5266535

SCHEMBL5266535

Cc1cc(N2CC(NC(=O)Oc3ccc(Br)s3)CC2=O)ccc1N1CCSCC1=O

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.41
POLB P06746 3/20 0.41
TP53 P04637 2/20 0.38
NCOA1 Q15788 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
KDM4E B2RXH2 1/20 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
SCHEMBL4516670 0.86 TP53 (0.45) LMNAPOLBTP53
SCHEMBL5266476 0.86 F10 (0.46) LMNAPOLBNCOA1NCOA3
SCHEMBL5266875 0.86 POLB (0.41) LMNAPOLBTP53NCOA1NCOA3
SCHEMBL5270690 0.85 POLB (0.40) LMNAPOLBTP53NCOA1NCOA3
SCHEMBL2767344 0.83 POLB (0.41) LMNAPOLBTP53NCOA1NCOA3
SCHEMBL5314536 0.82 F10 (0.40) LMNAPOLBTP53NCOA1NCOA3
SCHEMBL2765316 0.82 POLB (0.40) LMNAPOLBTP53NCOA1NCOA3
SCHEMBL2765973 0.82 POLB (0.40) LMNAPOLBTP53NCOA1NCOA3
SCHEMBL2767027 0.80 POLB (0.41) LMNAPOLBTP53NCOA1NCOA3
SCHEMBL2766124 0.80 LMNA (0.44) LMNAPOLBTP53KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1836198-A1 SUBSTITUTED PYRROLIDINONES HAVING AN ANTITHROMBOTIC EFFECT, THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2007-09-26 EP disclosed
WO-2006069946-A1 SUBSTITUTED PYRROLIDINONES HAVING AN ANTITHROMBOTIC EFFECT, THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-07-06 WO disclosed