Sugi Predict

Sugi Predict / Compounds / SCHEMBL8017356

SCHEMBL8017356

SCHEMBL8017356

CC(=O)NCCOC(=O)[C@H](Cc1ccc(-c2cccc3ccccc23)cc1)NC(=O)N(CC(C)C)CC(O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 12/20 0.58
▸ ACE P12821 12/20 0.58
▸ PPARG P37231 5/20 0.39
▸ PPARA Q07869 5/20 0.39
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HPGD P15428 1/20 0.37

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
SCHEMBL8017309 0.94 MME (0.59) MMEACEPPARGPPARA
SCHEMBL8032639 0.90 MME (0.71) MMEACE
SCHEMBL8447804 0.89 MME (0.64) MMEACEPPARGPPARA
SCHEMBL9007741 0.89 MME (0.64) MMEACEPPARGPPARA
SCHEMBL8017324 0.88 MME (0.63) MMEACE
SCHEMBL27441360 0.88 MME (0.63) MMEACE
SCHEMBL8017169 0.87 MME (0.64) MMEACE
SCHEMBL8027498 0.87 MME (0.75) MMEACEKDM4EALDH1A1HPGD
SCHEMBL8027420 0.87 MME (0.77) MMEACEPPARGPPARA
SCHEMBL8032886 0.85 MME (0.62) MMEACEPPARGPPARA

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