SCHEMBL4236771

SCHEMBL4236771

CCCCCCCCCC(=O)Nc1ccccc1-c1cnc(N)n1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 4/20 0.59
CETP P11597 1/20 0.48
LMNA P02545 1/20 0.47
PLA2G1B P04054 1/20 0.47
TSHR P16473 1/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
HDAC3 O15379 8/20 0.45
HDAC1 Q13547 8/20 0.45
HDAC2 Q92769 8/20 0.45
HDAC10 Q969S8 7/20 0.45
HDAC6 Q9UBN7 7/20 0.45
HDAC4 P56524 6/20 0.45
HDAC7 Q8WUI4 6/20 0.45
HDAC11 Q96DB2 6/20 0.45
HDAC8 Q9BY41 6/20 0.45
HDAC9 Q9UKV0 6/20 0.45
HDAC5 Q9UQL6 6/20 0.45
NCOR2 Q9Y618 3/20 0.45

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
SCHEMBL4232425 0.86 SOAT1 (0.50) SOAT1CETPLMNAPLA2G1BTSHR
SCHEMBL4064015 0.77 HDAC1 (0.40) SOAT1HDAC3HDAC1HDAC2HDAC10
SCHEMBL13655263 0.77 HDAC1 (0.40) SOAT1HDAC3HDAC1HDAC2HDAC10
SCHEMBL15472054 0.75 SOAT1 (1.00) SOAT1CETPLMNAPLA2G1BTSHR
SCHEMBL15472053 0.75 SOAT1 (1.00) SOAT1CETPLMNAPLA2G1BTSHR
SCHEMBL13655159 0.75 SOAT1 (0.59) SOAT1CETPLMNAPLA2G1BTSHR
SCHEMBL9901369 0.74 SOAT1 (0.91) SOAT1CETPTSHRHDAC3HDAC1
SCHEMBL5878480 0.73 CETP (0.77) SOAT1CETPLMNAPLA2G1BTSHR
SCHEMBL9395051 0.73 CETP (0.77) SOAT1CETPLMNAPLA2G1BTSHR
SCHEMBL14472972 0.72 HDAC3 (0.84) SOAT1CETPHDAC3HDAC1HDAC2

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-2009123753-A1 INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE-PHENYL DERIVATIVES NORTH CAROLINA STATE UNIVERSITY (US) 2009-10-08 WO disclosed