SCHEMBL14643286

SCHEMBL14643286

COC(=O)[C@H](C)N[P@](C)(=O)Oc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 10/20 0.54
LMNA P02545 1/20 0.46
MAPK1 P28482 1/20 0.46
HPGD P15428 2/20 0.44
KMT2A Q03164 2/20 0.42
MAPT P10636 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ELANE P08246 1/20 0.42
SRC P12931 1/20 0.42

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
SCHEMBL13656424 1.00 BTN3A1 (0.54) BTN3A1LMNAMAPK1HPGDKMT2A
SCHEMBL20959996 1.00 BTN3A1 (0.54) BTN3A1LMNAMAPK1HPGDKMT2A
SCHEMBL15507071 1.00 BTN3A1 (0.54) BTN3A1LMNAMAPK1HPGDKMT2A
SCHEMBL12378076 0.88 BTN3A1 (0.56) BTN3A1LMNAHPGDKMT2AMEN1
SCHEMBL19778357 0.88 BTN3A1 (0.56) BTN3A1LMNAHPGDKMT2AMEN1
SCHEMBL18067176 0.88 BTN3A1 (0.56) BTN3A1LMNAHPGDKMT2AMEN1
SCHEMBL15682968 0.88 BTN3A1 (0.56) BTN3A1LMNAHPGDKMT2AMEN1
SCHEMBL15685881 0.88 BTN3A1 (0.56) BTN3A1LMNAHPGDKMT2AMEN1
SCHEMBL12214044 0.88 BTN3A1 (0.56) BTN3A1LMNAHPGDKMT2AMEN1
SCHEMBL18512732 0.88 BTN3A1 (0.56) BTN3A1LMNAHPGDKMT2AMEN1

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-2013009737-A1 5'-SUBSTITUTED NUCLEOSIDE ANALOGS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES MERCK SHARP & DOHME CORP. (US) 2013-01-17 WO disclosed