SCHEMBL2669810

SCHEMBL2669810

CCCCCC(C)C(Nc1ccc(C(=O)N(C)CCC=O)cc1)c1oc2ccc(F)cc2c1COC

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.34
BRD4 O60885 1/20 0.32
TP53 P04637 2/20 0.30
MAPT P10636 1/20 0.30
PIK3CB P42338 1/20 0.30
KMT2A Q03164 2/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
MEN1 O00255 1/20 0.30
TSHR P16473 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL2669941 0.90 TP53 (0.36) NAMPTBRD4TP53MAPTPIK3CB
SCHEMBL2669899 0.85 NAMPT (0.36) NAMPTPIK3CB
SCHEMBL2669847 0.81 NAMPT (0.36) NAMPTBRD4PIK3CB
SCHEMBL2669784 0.81 NAMPT (0.33) NAMPTMAPTKMT2ANPC1RAB9A
SCHEMBL9070776 0.81 KMT2A (0.37) KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL2669769 0.80 NAMPT (0.36) NAMPTBRD4TP53PIK3CBKMT2A
SCHEMBL2669811 0.80 TP53 (0.34) TP53MAPTKMT2ANPC1RAB9A
SCHEMBL2669956 0.78 MAOB (0.35) NAMPTTP53MAPTKMT2AMEN1
SCHEMBL2669992 0.75 NAMPT (0.32) NAMPTMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL2669820 0.75 FAAH (0.35) NAMPT

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-2009110520-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-09-11 WO disclosed