SCHEMBL8347462

SCHEMBL8347462

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

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 9/20 0.52
METAP1 P53582 1/20 0.39
ANPEP P15144 6/20 0.39
ERAP1 Q9NZ08 1/20 0.39
ERAP2 Q6P179 1/20 0.33

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
SCHEMBL3175491 0.85 LAP3 (0.43) LAP3METAP1ANPEPERAP1
SCHEMBL3122525 0.83 LAP3 (0.50) LAP3METAP1
SCHEMBL4158116 0.81 LAP3 (0.59) LAP3
Oxalic Acid SCHEMBL1377705 0.79 LAP3 (0.40) LAP3METAP1ANPEP
SCHEMBL19245350 0.78 TRPM8 (0.35) LAP3METAP1
SCHEMBL10755198 0.77 LAP3 (0.33) LAP3METAP1
SCHEMBL4473853 0.77 LAP3 (0.33) LAP3METAP1
SCHEMBL6014564 0.75 LAP3 (0.41) LAP3METAP1ANPEPERAP1
Methane SCHEMBL3938662 0.75 LAP3 (0.32) LAP3METAP1
SCHEMBL485995 0.75

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-5861107-A ESTER INTERCHANGE OF 1,3-PROPANEDIOL COMPOUNDS WITH CARBONIC ACID ESTERS; DISTILLATIVE DEPOLYMERIZATION; CATALYSIS WITH TITANIUM OR ZIRCONIUM COMPOUND; PHOSPHORUS OR SULFUR COMPOUND STABILIZER BAYER AKTIENGESELLSCHAFT (DE) 1999-01-19 US disclosed