SCHEMBL7412646

SCHEMBL7412646

O=C(O)CC[C@@H](Cc1ccc(-c2ccccc2)cc1)NCP(=O)(O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.62
ECE1 P42892 1/20 0.50
AGTR2 P50052 1/20 0.50
ACP3 P15309 1/20 0.49
FFAR1 O14842 1/20 0.49
ACE P12821 2/20 0.48
MMEL1 Q495T6 1/20 0.48

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
SCHEMBL7412654 1.00 MME (0.62) MMEECE1AGTR2ACP3FFAR1
Hydrochloric Acid SCHEMBL7413814 0.85 MME (0.51) MMEECE1AGTR2ACP3ACE
Hydrochloric Acid SCHEMBL7413822 0.85 MME (0.51) MMEECE1AGTR2ACP3ACE
SCHEMBL7411689 0.85 MME (0.57) MMEFFAR1ACEMMEL1
SCHEMBL7407913 0.84 MME (0.56) MMEFFAR1ACEMMEL1
SCHEMBL7411695 0.80 MME (0.60) MMEFFAR1ACEMMEL1
SCHEMBL7411683 0.80 MME (0.60) MMEFFAR1ACEMMEL1
SCHEMBL7411127 0.79 MME (0.62) MMEECE1AGTR2ACP3ACE
SCHEMBL7411123 0.79 MME (0.62) MMEECE1AGTR2ACP3ACE
SCHEMBL489232 0.79 MMEL1 (0.64) MMEECE1ACEMMEL1

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 6 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
WO-1996026729-A1 PHOSPHONO SUBSTITUTED TETRAZOLE DERIVATIVES AS ECE INHIBITORS CIBA-GEIGY AG (CH) 1996-09-06 WO 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-5250522-A Neutral endopeptidase inhibitors; cardiovascular disorders CIBA-GEIGY CORPORATION (US) 1993-10-05 US disclosed