SCHEMBL27159397

SCHEMBL27159397

Cc1ccc(C(C)(NC(=O)OC(C)(C)C)C(=O)O)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.41
PPARG P37231 2/20 0.41
NPC1 O15118 2/20 0.39
MAPT P10636 2/20 0.39
RAB9A P51151 2/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
ATM Q13315 1/20 0.38
AKT1 P31749 2/20 0.37
CTSS P25774 2/20 0.36
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
CTSK P43235 1/20 0.36
TSHR P16473 2/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 2/20 0.36
SYK P43405 1/20 0.36
MEN1 O00255 1/20 0.35

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
SCHEMBL27159394 1.00 PPARA (0.41) PPARAPPARGNPC1MAPTRAB9A
SCHEMBL4221670 0.87 MIF (0.47) PPARANPC1RAB9ACA12CA1
SCHEMBL19331927 0.87 MIF (0.47) PPARANPC1RAB9ACA12CA1
SCHEMBL1951583 0.87 CA12 (0.47) PPARAPPARGNPC1RAB9ACA12
SCHEMBL1951666 0.87 CA12 (0.47) PPARAPPARGNPC1RAB9ACA12
SCHEMBL2953752 0.87 CA12 (0.47) PPARAPPARGNPC1RAB9ACA12
SCHEMBL3946429 0.86 GAA (0.44) PPARAPPARGNPC1MAPTRAB9A
SCHEMBL1208679 0.86 NPC1 (0.48) NPC1MAPTRAB9ACA12CA1
SCHEMBL27159043 0.86 GAA (0.44) PPARAPPARGNPC1MAPTRAB9A
SCHEMBL2953651 0.84 CTSS (0.46) PPARAPPARGNPC1MAPTCA12

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-4332089-A1 METHOD FOR PREPARING AMINO ACIDS PHILIPPS-UNIVERSITÄT MARBURG (DE) 2024-03-06 EP disclosed