SCHEMBL27464506

SCHEMBL27464506

CCOC(=O)C(O)CN(CC(C)C)C(=O)NC(C(=O)O)C(C)C

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 6/20 0.43
▸ ACE P12821 6/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ PLA2G2A P14555 1/20 0.35
▸ PLA2G5 P39877 1/20 0.35
▸ PPARG P37231 2/20 0.34
▸ PPARA Q07869 1/20 0.34

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
SCHEMBL8026913 1.00 MME (0.43) MMEACENPSR1ALDH1A1SMN1; SMN2
SCHEMBL8026918 1.00 MME (0.43) MMEACENPSR1ALDH1A1SMN1; SMN2
SCHEMBL8027558 0.87 MME (0.53) MMEACENPSR1ALDH1A1SMN1; SMN2
SCHEMBL8027559 0.87 MME (0.53) MMEACENPSR1ALDH1A1SMN1; SMN2
SCHEMBL8027297 0.86 MME (0.44) MMEACEALDH1A1SMN1; SMN2
SCHEMBL8027302 0.86 MME (0.44) MMEACEALDH1A1SMN1; SMN2
SCHEMBL27464505 0.86 MME (0.44) MMEACEALDH1A1SMN1; SMN2
SCHEMBL8027100 0.81 MME (0.49) MMEACEALDH1A1
SCHEMBL8027105 0.81 MME (0.49) MMEACEALDH1A1
SCHEMBL8451445 0.76 MME (0.36) MMEACEALDH1A1

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
CN-1138321-A 1, 3-dialkyl urea derivative with hydrocarbon group SANTAN PHARMACEUTICAL CO LTD (JP) 1996-12-18 — — CN disclosed
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