SCHEMBL775707

SCHEMBL775707

CCCC(=O)NC1=C(NC(=O)CCC)CCC=C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.41
ALDH1A1 P00352 4/20 0.38
THRB P10828 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
THRA P10827 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPK1 P28482 1/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.37
NSD2 O96028 1/20 0.36
TTR P02766 1/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36

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
SCHEMBL774571 0.89 SOAT1 (0.42) LMNAMAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL774744 0.88 SOAT1 (0.44) LMNAMAPK1RAB9APOLB
SCHEMBL775687 0.88 SOAT1 (0.44) LMNAMAPK1RAB9APOLB
SCHEMBL774641 0.83 TP53 (0.43) TP53ALDH1A1THRBMEN1LMNA
SCHEMBL776246 0.79 PTPN1 (0.42) ALDH1A1LMNAMAPK1MAPTKDM4E
SCHEMBL775558 0.73 SOAT1 (0.43) LMNAMAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL776835 0.72 SOAT1 (0.46) LMNARAB9ACA1CA2POLB
SCHEMBL774986 0.72 SOAT1 (0.46) LMNARAB9ACA1CA2POLB
SCHEMBL23871973 0.70 TP53 (0.43) TP53ALDH1A1THRBMEN1LMNA
SCHEMBL8016937 0.69 KDM4E (0.35) TP53ALDH1A1LMNAKMT2AMAPK1

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
US-8673998-B2 Polymer compositions with improved cold flow BRIDGESTONE CORPORATION (JP) 2014-03-18 US disclosed
US-20120071583-A1 POLYMER COMPOSITIONS WITH IMPROVED COLD FLOW BRIDGESTONE CORPORATION (JP) 2012-03-22 US disclosed