SCHEMBL9690184

SCHEMBL9690184

COc1ccccc1C1OC1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 3/20 0.46
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
FABP5 Q01469 4/20 0.44
FABP7 O15540 2/20 0.44
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA12 O43570 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
USP2 O75604 1/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
LMNA P02545 1/20 0.41
ALOX15 P16050 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
SCHEMBL10477591 0.98 FABP3 (0.45) FABP3KMT2AMEN1FABP5FABP7
SCHEMBL10477595 0.98 FABP3 (0.45) FABP3KMT2AMEN1FABP5FABP7
SCHEMBL10894837 0.85 ALDH1A1 (0.43) FABP3KMT2AMEN1FABP5FABP7
SCHEMBL10477592 0.83 MEN1 (0.41) FABP3KMT2AMEN1CA1CA2
SCHEMBL29199108 0.80 TSHR (0.61) KMT2AMEN1FABP5CA1CA2
SCHEMBL28986253 0.80 MAOB (0.43) KMT2AMEN1ALDH1A1KDM4ETSHR
SCHEMBL30219644 0.80 MAOB (0.43) KMT2AMEN1ALDH1A1KDM4ETSHR
SCHEMBL28802498 0.79 ALDH1A1 (0.41) KMT2AMEN1FABP5ALDH1A1KDM4E
SCHEMBL4729436 0.75 MEN1 (0.43) FABP3KMT2AMEN1FABP5FABP7
SCHEMBL9616713 0.75 TSHR (0.46) KMT2AMEN1ALDH1A1KDM4ETP53

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-0153692-B1 METHOD FOR ISOMERIZATION A GLYCIDATE DERIVATIVE SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-07-29 EP disclosed
EP-0153692-A2 Method for isomerization a glycidate derivative SAGAMI CHEMICAL RESEARCH CENTER (JP) 1985-09-04 EP disclosed