SCHEMBL15580424

SCHEMBL15580424

CC(C)(C)OC(=O)N[C@]1(C(=O)NO)C[C@H](OCc2ccccc2)C1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.42
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
EPHX2 P34913 1/20 0.40
KLK7 P49862 4/20 0.40
KLK5 Q9Y337 3/20 0.40
SYK P43405 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA7 P43166 1/20 0.39
CA14 Q9ULX7 1/20 0.39
HDAC4 P56524 2/20 0.38
CTSL P07711 2/20 0.38
CTSS P25774 2/20 0.38
CTSB P07858 1/20 0.38
PPARG P37231 1/20 0.38
AKT1 P31749 2/20 0.38
GHSR Q92847 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
SCHEMBL15580417 0.91 PPARA (0.44) PPARAKMT2AL3MBTL1EPHX2KLK7
SCHEMBL5237487 0.90 KMT2A (0.43) PPARAKMT2AL3MBTL1EPHX2KLK7
SCHEMBL14416216 0.90 KMT2A (0.43) PPARAKMT2AL3MBTL1EPHX2KLK7
SCHEMBL14416217 0.87 KLK7 (0.43) PPARAKMT2AL3MBTL1EPHX2KLK7
SCHEMBL296601 0.84 SYK (0.43) PPARAKMT2AL3MBTL1EPHX2KLK7
SCHEMBL15306512 0.84 SYK (0.43) PPARAKMT2AL3MBTL1EPHX2KLK7
SCHEMBL7936447 0.83 OPRM1 (0.44) PPARAKMT2AL3MBTL1EPHX2KLK7
SCHEMBL5235644 0.82 SYK (0.41) PPARAKMT2AL3MBTL1EPHX2KLK7
SCHEMBL17691231 0.81 EPHX2 (0.42) PPARAKMT2AL3MBTL1EPHX2KLK7
SCHEMBL7932810 0.81 OPRM1 (0.43) PPARAKMT2AL3MBTL1EPHX2KLK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2172459-B1 COMPOUND HAVING HYDANTOIN RING AND METHOD OF PRODUCING THE SAME TOKUYAMA CORP (JP) 2014-03-19 EP disclosed