SCHEMBL2765417

SCHEMBL2765417

O=C(N[C@@H]1CC(=O)N(c2ccc(C(=O)N3CCCC3)cc2)C1)Oc1ccc(Br)s1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 8/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
MAPT P10636 3/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 2/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL2765103 0.89 LMNA (0.43) LMNAALDH1A1HPGDMAPTKDM4E
SCHEMBL2766124 0.87 LMNA (0.44) LMNAMAPTKDM4ETP53POLB
SCHEMBL2765569 0.87 LMNA (0.46) LMNAMAPTKDM4ETP53POLB
SCHEMBL2767137 0.87 LMNA (0.46) LMNAMAPTKDM4ETP53POLB
SCHEMBL3285554 0.84 LMNA (0.50) LMNAALDH1A1HPGDRXFP1MAPT
SCHEMBL5266162 0.84 F10 (0.42) LMNAMAPTKDM4ETP53POLB
SCHEMBL5264221 0.82 TP53 (0.41) LMNAALDH1A1MAPTKDM4ETP53
SCHEMBL2766741 0.81 POLB (0.41) LMNAALDH1A1MAPTKDM4ETP53
SCHEMBL2766936 0.81 LMNA (0.40) LMNAMAPTKDM4ETP53POLB
SCHEMBL2765159 0.81 POLB (0.41) LMNAALDH1A1MAPTKDM4ETP53

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