SCHEMBL7168982

SCHEMBL7168982

CCCC(NC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.45
KCNN4 O15554 2/20 0.43
FPR2 P25090 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KIF11 P52732 5/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.40
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
PPARG P37231 2/20 0.38
PPARA Q07869 2/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38

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
SCHEMBL3607588 0.90 MME (0.47) MMEKCNN4NPSR1KIF11POLB
SCHEMBL2742288 0.86 KCNN4 (0.46) MMEKCNN4NPSR1RAB9AKIF11
SCHEMBL29908038 0.85 NPSR1 (0.43) KCNN4NPSR1KIF11CNR1CNR2
SCHEMBL13726857 0.83 NAALAD2 (0.51) NPSR1
SCHEMBL4627986 0.83 NAALAD2 (0.51) NPSR1
SCHEMBL28500174 0.83 NPSR1 (0.42) MMEKCNN4NPSR1KIF11CNR1
SCHEMBL4627982 0.83 NAALAD2 (0.51) NPSR1
SCHEMBL29478394 0.83 NPSR1 (0.42) MMEKCNN4NPSR1KIF11CNR1
Diethylamine SCHEMBL30092414 0.83 KCNN4 (0.41) KCNN4NPSR1KIF11LMNAPOLB
Diethylamine SCHEMBL28968612 0.83 KCNN4 (0.41) KCNN4NPSR1KIF11LMNAPOLB

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-1311488-A1 SUBSTITUTED IMIDAZOLES AS TAFIA INHIBITORS Pfizer Limited (GB) 2003-05-21 EP disclosed
WO-2002014285-A1 SUBSTITUTED IMIDAZOLES AS TAFIA INHIBITORS PFIZER LIMITED (GB) 2002-02-21 WO disclosed