SCHEMBL8017254

SCHEMBL8017254

CC(C)CN(CC(O)C(=O)O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)Oc1ccc2c(c1)CCC2

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MME P08473 14/20 0.69
ACE P12821 13/20 0.69
PPARG P37231 2/20 0.41
PPARD Q03181 2/20 0.41
CPA1 P15085 1/20 0.39
ACE2 Q9BYF1 1/20 0.39
TACR1 P25103 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
SCHEMBL8447724 1.00 MME (0.69) MMEACEPPARGPPARDCPA1
SCHEMBL8017192 0.94 MME (0.70) MMEACEPPARGPPARDCPA1
SCHEMBL8027099 0.94 MME (0.60) MMEACEPPARGPPARD
SCHEMBL8521923 0.94 MME (0.60) MMEACEPPARGPPARD
SCHEMBL8030944 0.93 MME (0.57) MMEACEPPARGPPARD
SCHEMBL8030949 0.93 MME (0.57) MMEACEPPARGPPARD
SCHEMBL8448377 0.93 MME (0.57) MMEACEPPARGPPARD
SCHEMBL8027626 0.92 MME (0.65) MMEACEPPARGPPARD
SCHEMBL8523126 0.92 MME (0.65) MMEACEPPARGPPARD
SCHEMBL8027621 0.92 MME (0.65) 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 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