SCHEMBL8260784

SCHEMBL8260784

Cc1cc(N2CC(NC(=O)c3ccc(Br)s3)CC2=O)ccc1C(=O)N1CCCC1C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.44
LMNA P02545 4/20 0.43
POLB P06746 2/20 0.43
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
F10 P00742 2/20 0.37
BCAT2 O15382 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
SCHEMBL3284754 1.00 TP53 (0.44) TP53LMNAPOLBALDH1A1HPGD
SCHEMBL3284654 0.91 LMNA (0.45) TP53LMNAPOLBALDH1A1HPGD
SCHEMBL3286086 0.91 TP53 (0.44) TP53LMNAPOLBALDH1A1HPGD
SCHEMBL3291313 0.91 TP53 (0.42) TP53LMNAPOLBALDH1A1HPGD
SCHEMBL3285180 0.90 TP53 (0.45) TP53LMNAPOLBALDH1A1HPGD
SCHEMBL3291733 0.89 LMNA (0.44) TP53LMNAPOLBALDH1A1HPGD
SCHEMBL2768223 0.88 TP53 (0.42) TP53LMNAPOLBALDH1A1HPGD
SCHEMBL3284382 0.88 TP53 (0.43) TP53LMNAPOLBALDH1A1HPGD
SCHEMBL3285196 0.88 LMNA (0.48) TP53LMNAPOLBALDH1A1HPGD
SCHEMBL3288361 0.87 TP53 (0.44) TP53LMNAPOLBALDH1A1HPGD

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
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