SCHEMBL8030176

SCHEMBL8030176

CC(C)CN(CC(O)C(=O)O)C(=O)N[C@H](C(=O)O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 10/20 0.61
▸ ACE P12821 8/20 0.61
▸ LTA4H P09960 1/20 0.47
▸ ANPEP P15144 1/20 0.47
▸ AOC3 Q16853 1/20 0.40
▸ NAALAD2 Q9Y3Q0 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ CTDSP1 Q9GZU7 1/20 0.40
▸ ATM Q13315 1/20 0.39
▸ FOLH1 Q04609 1/20 0.39

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
SCHEMBL8030181 1.00 MME (0.61) MMEACELTA4HANPEPAOC3
SCHEMBL8456166 1.00 MME (0.61) MMEACELTA4HANPEPAOC3
SCHEMBL8028822 0.92 MME (0.69) MMEACELTA4HANPEPFOLH1
SCHEMBL8448688 0.92 MME (0.69) MMEACELTA4HANPEPFOLH1
SCHEMBL8028819 0.92 MME (0.69) MMEACELTA4HANPEPFOLH1
SCHEMBL8452375 0.86 MME (0.55) MMEACEATM
SCHEMBL9007772 0.86 MME (0.55) MMEACEATM
SCHEMBL8026907 0.86 MME (0.55) MMEACEATM
SCHEMBL8454383 0.85 MME (0.62) MMEACEATM
SCHEMBL8030967 0.85 MME (0.62) MMEACEATM

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-0738711-B1 NOVEL 1,3-DIALKYLUREA DERIVATIVE HAVING HYDROXYL GROUP SANTEN PHARMACEUTICAL CO LTD (JP) 2000-03-08 — — EP disclosed
EP-0738711-A1 NOVEL 1,3-DIALKYLUREA DERIVATIVE HAVING HYDROXYL GROUP SANTEN PHARMACEUTICAL CO., LTD. (JP) 1996-10-23 — — EP disclosed
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