SCHEMBL7567828

SCHEMBL7567828

CC(C)CN(C[C@H](OCc1ccccc1)C(=O)Oc1ccc2c(c1)CCC2)C(=O)N[C@@H](Cc1ccc(-c2ccccc2)cc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MME P08473 6/20 0.53
ACE P12821 5/20 0.53
GPR34 Q9UPC5 7/20 0.42
MMEL1 Q495T6 1/20 0.40
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PTPN1 P18031 1/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL7567819 1.00 MME (0.53) MMEACEGPR34MMEL1PPARG
SCHEMBL8449910 0.95 MME (0.46) MMEACEGPR34MMEL1PPARG
SCHEMBL8449913 0.89 MME (0.40) MMEACEGPR34MMEL1PPARG
SCHEMBL7569408 0.89 MME (0.56) MMEACEGPR34MMEL1PPARG
SCHEMBL7569417 0.89 MME (0.56) MMEACEGPR34MMEL1PPARG
SCHEMBL8027609 0.89 MME (0.66) MMEACEGPR34MMEL1PPARG
SCHEMBL7566387 0.87 MME (0.55) MMEACEGPR34MMEL1PPARG
SCHEMBL7566393 0.87 MME (0.55) MMEACEGPR34MMEL1PPARG
SCHEMBL8017295 0.86 MME (0.58) MMEACEPPARGPPARD
SCHEMBL8017292 0.86 MME (0.58) MMEACEPPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0798291-B1 NOVEL 1,3-DIALKYLUREA DERIVATIVES SANTEN PHARMACEUTICAL CO LTD (JP) 2002-09-11 EP disclosed
US-5968980-A ENDOPEPTIDASE 24.11 INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1999-10-19 US disclosed
EP-0798291-A1 NOVEL 1,3-DIALKYLUREA DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1997-10-01 EP disclosed