SCHEMBL7570062

SCHEMBL7570062

CC(=O)O[C@H](C)[C@@H](CCc1ccccc1)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 2/20 0.45
MMP13 P45452 1/20 0.45
ACACB O00763 4/20 0.44
ACACA Q13085 3/20 0.44
FFAR1 O14842 1/20 0.44
NPY5R Q15761 1/20 0.44
SRD5A2 P31213 2/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL7568081 0.85 TTR (0.46) MMP12MEN1KMT2A
SCHEMBL7561992 0.82 NPSR1 (0.43) ACACBACACAFFAR1MEN1KMT2A
SCHEMBL7568124 0.81 MMP12 (0.48) MMP12MMP13ACACBACACAFFAR1
SCHEMBL7562938 0.81 MMP12 (0.48) MMP12MMP13ACACBACACAFFAR1
SCHEMBL7562523 0.78 MMP12 (0.42) MMP12MMP13FFAR1
SCHEMBL7562926 0.77 FFAR1 (0.50) MMP12MMP13ACACBACACAFFAR1
SCHEMBL7563791 0.76 PTGS1 (0.57) MMP12FFAR1MEN1KMT2A
SCHEMBL7561384 0.76 ALDH1A1 (0.43) MMP12MMP13ACACBACACAFFAR1
SCHEMBL7561981 0.73 SMN1; SMN2 (0.47) MMP12MMP13ACACBACACAFFAR1
SCHEMBL7561017 0.73 SMN1; SMN2 (0.45) MMP12MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882703-B1 CYCLIC AMIC ACID DERIVATIVES BANYU PHARMA CO LTD (JP) 2002-08-14 EP disclosed
US-6011174-A INHIBIT PROTEIN-FARNESYL TRANSFERASE (PFT) IN VIVO THEREBY TO SUPPRESS FUNCTION OF ONCOGENE PROTEIN RAS AND THUS PRESENT ANTITUMOR ACTIVITIES, BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-01-04 US disclosed
EP-0882703-A1 CYCLIC AMIC ACID DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-12-09 EP disclosed