SCHEMBL7437148

SCHEMBL7437148

COC(=O)C(OS(C)(=O)=O)c1ccc(OC)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
ACHE P22303 1/20 0.46
MMP1 P03956 2/20 0.46
MMP13 P45452 2/20 0.46
RAB9A P51151 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
KLK7 P49862 1/20 0.43
NR3C2 P08235 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42
NPC1 O15118 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL6621061 0.88 ENPP3 (0.41) CA1CA2ACHEMMP1MMP13
SCHEMBL19716753 0.85 CA1 (0.46) CA1CA2ACHERAB9ANPSR1
SCHEMBL17309222 0.84 RAB9A (0.49) CA1CA2RAB9ANPSR1MEN1
SCHEMBL17309221 0.84 RAB9A (0.49) CA1CA2RAB9ANPSR1MEN1
SCHEMBL1533409 0.84 RAB9A (0.49) CA1CA2RAB9ANPSR1MEN1
SCHEMBL9128620 0.83 MAPT (0.55) CA1CA2RAB9ANPSR1MEN1
SCHEMBL7447940 0.83 CYP1A2 (0.44) KMT2ASMN1; SMN2
SCHEMBL5918040 0.83 L3MBTL1 (0.46) CA1CA2NR3C2
SCHEMBL7434531 0.83 KMT2A (0.45) MEN1KMT2ANR3C2LMNAGAA
SCHEMBL2488220 0.82 KMT2A (0.58) MEN1KMT2AKLK7LMNAGAA

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
EP-0623120-A1 PIPERIDINEACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1994-11-09 EP disclosed
WO-1993014077-A1 PIPERIDINEACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1993-07-22 WO disclosed