SCHEMBL16348702

SCHEMBL16348702

C[C@H](NCc1ccccc1)C(=O)OP(=O)(O)Cl

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 4/20 0.47
MAPT P10636 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SIGMAR1 Q99720 1/20 0.41
MEP1B Q16820 2/20 0.40
POLB P06746 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL28899399 1.00 ACP3 (0.47) ACP3MAPTL3MBTL1MEN1KMT2A
SCHEMBL28464084 0.86 ACP3 (0.44) ACP3MAPTL3MBTL1MEN1KMT2A
SCHEMBL15721086 0.84 KMT2A (0.44) ACP3MAPTL3MBTL1MEN1KMT2A
SCHEMBL28499340 0.82 ACP3 (0.51) ACP3MAPTMEN1KMT2ASIGMAR1
SCHEMBL4282571 0.81 CA1 (0.46) ALDH1A1
SCHEMBL4282703 0.81 CA1 (0.46) ALDH1A1
SCHEMBL27536452 0.81 CA1 (0.46) ALDH1A1
SCHEMBL106076 0.80 MAPT (0.67) MAPTL3MBTL1MEN1KMT2ASIGMAR1
SCHEMBL106075 0.80 MAPT (0.67) MAPTL3MBTL1MEN1KMT2ASIGMAR1
SCHEMBL914510 0.80 MAPT (0.67) MAPTL3MBTL1MEN1KMT2ASIGMAR1

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-8933053-B2 Phosphoramidate derivatives of 5-fluoro-2′-deoxyuridine for use in the treatment of cancer NUCANA BIOMED LIMITED (GB) 2015-01-13 US disclosed