SCHEMBL10933488

SCHEMBL10933488

COC(=O)C(O)CC(=O)[O-].[Mg+]

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA4 P22748 4/20 0.52
CA2 P00918 2/20 0.41
SLC22A16 Q86VW1 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.36
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
CPT2 P23786 1/20 0.33
CPT1A P50416 1/20 0.33
CYP1A2 P05177 1/20 0.33
HRH1 P35367 1/20 0.33
CRAT P43155 1/20 0.33
CTSL P07711 1/20 0.33
CA1 P00915 1/20 0.32
CYP2C19 P33261 1/20 0.32
RECQL P46063 1/20 0.32

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
SCHEMBL10933480 0.95 CA4 (0.52) CA4CA2SLC22A16SMN1; SMN2KMT2A
SCHEMBL5372332 0.91 CA4 (0.48) CA4CA2SLC22A16SMN1; SMN2KMT2A
SCHEMBL1823637 0.76 TSHR (0.43) CA2SMN1; SMN2KMT2AMEN1CA1
SCHEMBL8060426 0.76 ALDH1A1 (0.42) CA2SMN1; SMN2KMT2ACA1
SCHEMBL8060423 0.76 ALDH1A1 (0.42) CA2SMN1; SMN2KMT2ACA1
SCHEMBL9040323 0.76 SMN1; SMN2 (0.52) CA2SMN1; SMN2KMT2ACA1
SCHEMBL222024 0.76 SMN1; SMN2 (0.52) CA2SMN1; SMN2KMT2ACA1
SCHEMBL206973 0.76 SMN1; SMN2 (0.52) CA2SMN1; SMN2KMT2ACA1
SCHEMBL1691025 0.76 TSHR (0.43) CA2SMN1; SMN2KMT2AMEN1CA1
SCHEMBL205700 0.76 TSHR (0.43) CA2SMN1; SMN2KMT2AMEN1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-60170648-A None JP disclosed
JP-S60170648-A NON-RIGID VINYL CHLORIDE RESIN COMPOSITION NIPPON ZEON CO LTD 1985-09-04 JP disclosed