SCHEMBL8729156

SCHEMBL8729156

CC(C)(C)OC(=O)NCCc1ccc(OCO[PH](=O)C2CCCCC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.42
EPHX1 P07099 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
CA1 P00915 6/20 0.41
CA2 P00918 6/20 0.41
CA12 O43570 5/20 0.40
CA9 Q16790 5/20 0.40
ALDH1A1 P00352 1/20 0.40
IGF1R P08069 1/20 0.39
IDO1 P14902 1/20 0.38
GLA P06280 1/20 0.37
MAPT P10636 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
EPHX2 P34913 1/20 0.37

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
SCHEMBL8732412 0.84 CA2 (0.47) NAMPTKMT2ACA1CA2CA12
SCHEMBL28463594 0.77 NAMPT (0.49) NAMPTKMT2ACA1CA2CA12
SCHEMBL8729155 0.76 NAMPT (0.43) NAMPTEPHX1KMT2AMEN1CA1
SCHEMBL27741033 0.75 ACACB (0.59) NAMPTKMT2ACA1CA2CA12
SCHEMBL8733934 0.74 NAMPT (0.48) NAMPTKMT2ACA1CA2CA12
SCHEMBL5892281 0.74 CA1 (0.55) NAMPTKMT2AMEN1CA1CA2
SCHEMBL1541945 0.74 CA1 (0.64) NAMPTKMT2AMEN1CA1CA2
SCHEMBL19003451 0.73 ACACB (0.61) NAMPTKMT2AMEN1CA1CA2
SCHEMBL26964370 0.73 CA1 (0.56) NAMPTKMT2ACA1CA2CA12
SCHEMBL4427701 0.73 PTPN1 (0.52) NAMPTKMT2ACA1CA2CA12

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
US-5726165-A HYPOGLYCEMIC AGENTS; DIETETICS; GASTROINTESTINAL DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 1998-03-10 US disclosed