SCHEMBL4825537

SCHEMBL4825537

CC(=O)C(N)OP(=O)(O)O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.35
LAP3 P28838 6/20 0.33
SMPD1 P17405 3/20 0.33
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31
METAP1 P53582 1/20 0.31
FDPS P14324 1/20 0.30
BLM P54132 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
ANPEP P15144 2/20 0.30
ERAP1 Q9NZ08 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
SCHEMBL23015996 0.77 PGK1 (0.38) CA4LAP3
SCHEMBL183389 0.72 SMPD1 (0.34) CA4SMPD1FDPSBLMTDP1
SCHEMBL43278 0.72 SMPD1 (0.34) CA4SMPD1FDPSBLMTDP1
SCHEMBL63997 0.70
SCHEMBL7059623 0.70 SMPD1 (0.33) SMPD1FDPSBLMTDP1
Ammonia Solution, Strong SCHEMBL28328876 0.70 SMPD1 (0.33) SMPD1FDPSBLMTDP1
Phosphoric Acid SCHEMBL2148162 0.70 SMPD1 (0.33) SMPD1FDPSBLMTDP1
SCHEMBL3372760 0.69 FDPS (0.39) CA4LAP3SMPD1METAP1FDPS
SCHEMBL5436820 0.69
SCHEMBL5423146 0.69

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7371547-B2 Process for producing vitamin B6 DSM IP ASSETS B.V. (NL) 2008-05-13 US disclosed
EP-1543104-B1 MICROORGANISM AND PROCESS FOR PREPARING VITAMIN B6 DSM IP ASSETS BV (NL) 2007-04-18 EP disclosed
US-20060216798-A1 Process for producing vitamin b6 DSM IP ASSETS B.V. (NL) 2006-09-28 US disclosed
EP-1543138-B1 PROCESS FOR PRODUCING VITAMIN B6 DSM IP ASSETS BV (NL) 2006-08-02 EP disclosed
US-20060127992-A1 Microorganism and process for preparing vitamin b6 DSM IP ASSETS B.V. (NL) 2006-06-15 US disclosed
EP-1543104-A1 MICROORGANISM AND PROCESS FOR PREPARING VITAMIN B6 DSM IP Assets B.V. (NL) 2005-06-22 EP disclosed
WO-2004029228-A1 MICROORGANISM AND PROCESS FOR PREPARING VITAMIN B6 DSM IP ASSETS B.V. (NL) 2004-04-08 WO disclosed