SCHEMBL8922235

SCHEMBL8922235

COc1cccc(-c2ccc(C[C@H](NCP(=O)(O)O)c3nnn[nH]3)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MME P08473 6/20 0.51
ECE1 P42892 6/20 0.51
AGTR2 P50052 1/20 0.51
XDH P47989 1/20 0.39
MAOB P27338 2/20 0.39
IDH1 O75874 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
SCHEMBL8922277 1.00 MME (0.51) MMEECE1AGTR2XDHMAOB
SCHEMBL8923159 0.90 MME (0.45) MMEECE1AGTR2XDHIDH1
SCHEMBL8923142 0.90 MME (0.45) MMEECE1AGTR2XDHIDH1
SCHEMBL8922366 0.88 MME (0.42) MMEECE1AGTR2XDHMAOB
SCHEMBL8921961 0.88 MME (0.46) MMEECE1AGTR2
SCHEMBL8921967 0.88 MME (0.46) MMEECE1AGTR2
SCHEMBL8922375 0.88 MME (0.42) MMEECE1AGTR2XDHMAOB
SCHEMBL8922286 0.86 MME (0.42) MMEECE1AGTR2XDHMAOB
SCHEMBL8921613 0.86 MME (0.43) MMEECE1AGTR2
SCHEMBL8921594 0.86 MME (0.43) MMEECE1AGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0660840-B1 PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES CIBA GEIGY AG (CH) 1997-05-07 EP disclosed
US-5550119-A ENDOTHELIN-CONVERTING ENZYM INHIBITORS CIBA-GEIGY CORPORATION (US) 1996-08-27 US disclosed
EP-0660840-A1 PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES. CIBA GEIGY AG (CH) 1995-07-05 EP disclosed
WO-1994005677-A1 PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES CIBA-GEIGY AG (CH) 1994-03-17 WO disclosed
US-5273990-A 5-Phosphonomethyleneamino aryl-substitued alkylene-1H-tetazoles CIBA-GEIGY CORPORATION (US) 1993-12-28 US disclosed