SCHEMBL6573174

SCHEMBL6573174

OC1CC[C@H](Oc2ccc(-c3ccccc3)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.47
CHEK2 O96017 1/20 0.45
EPHX2 P34913 1/20 0.44
SLC6A2 P23975 5/20 0.44
SLC6A3 Q01959 4/20 0.44
SLC6A4 P31645 5/20 0.42
HRH1 P35367 1/20 0.41
MMP3 P08254 1/20 0.40
MAP4K4 O95819 1/20 0.38
FURIN P09958 1/20 0.38

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
SCHEMBL5390747 1.00 NAAA (0.47) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL5375025 1.00 NAAA (0.47) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL5375027 1.00 NAAA (0.47) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL5387056 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL6575789 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL5394014 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL5386182 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL5383373 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL5375836 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3
SCHEMBL6575784 0.90 FURIN (0.46) NAAACHEK2EPHX2SLC6A2SLC6A3

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-1392637-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2004-03-03 EP disclosed
WO-2002100813-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2002-12-19 WO disclosed