SCHEMBL8932450

SCHEMBL8932450

O=C(O)C(Cc1ccc(-c2ccccc2)cc1)NCP(=O)(O)Oc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MME P08473 6/20 0.47
ACE P12821 4/20 0.47
PPARG P37231 6/20 0.47
PPARA Q07869 5/20 0.47
ECE1 P42892 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CPA1 P15085 3/20 0.46
ACE2 Q9BYF1 3/20 0.46

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
SCHEMBL7415763 0.90 MME (0.49) MMEACEKMT2A
SCHEMBL7411238 0.89 PPARG (0.48) MMEACEPPARGPPARAECE1
SCHEMBL7407908 0.89 KMT2A (0.47) MMEACEECE1MEN1KMT2A
SCHEMBL7413345 0.88 MME (0.46) MMEACEPPARGPPARAECE1
SCHEMBL7407175 0.88 MME (0.48) MMEACEPPARGPPARACPA1
SCHEMBL7410891 0.88 FPR2 (0.46) MMEACEPPARGPPARAMEN1
SCHEMBL7414734 0.87 ITGA4 (0.54) PPARGPPARA
SCHEMBL7316584 0.84 MMEL1 (0.57) MMEACE
SCHEMBL7310423 0.84 MMEL1 (0.57) MMEACE
SCHEMBL7411127 0.84 MME (0.62) MMEACEECE1MEN1KMT2A

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
WO-1996026729-A1 PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES AS ECE INHIBITORS CIBA-GEIGY AG (CH) 1996-09-06 WO disclosed