SCHEMBL7413775

SCHEMBL7413775

Cc1cccc(OP(=O)(CN[C@@H](Cc2ccc(-c3ccccc3)cc2)C(=O)O)Oc2cccc(C)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.49
PPARA Q07869 1/20 0.49
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
CTSL P07711 1/20 0.44
CTSS P25774 1/20 0.44
MME P08473 9/20 0.43
ACE P12821 7/20 0.43
ACE2 Q9BYF1 6/20 0.43
CPA1 P15085 5/20 0.43
GPR34 Q9UPC5 5/20 0.42
ECE1 P42892 1/20 0.41

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
SCHEMBL7412181 0.91 MME (0.44) PPARGPPARAMMEACEACE2
SCHEMBL7411238 0.90 PPARG (0.48) PPARGPPARALMNAMAPTHTT
SCHEMBL7415659 0.89 KMT2A (0.48) MMEACEACE2CPA1
SCHEMBL7407175 0.89 MME (0.48) PPARGPPARAMMEACEACE2
SCHEMBL7419794 0.86 MME (0.50) MMEGPR34
SCHEMBL31510352 0.82 ANPEP (0.48) HTTMMEACEACE2CPA1
SCHEMBL7413345 0.81 MME (0.46) PPARGPPARAMMEACEACE2
SCHEMBL7322712 0.80 MME (0.51) MMEACEACE2CPA1
SCHEMBL7348038 0.80 MME (0.51) MMEACEACE2CPA1
SCHEMBL7407908 0.80 KMT2A (0.47) MMEACEACE2CPA1ECE1

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-5250522-A Neutral endopeptidase inhibitors; cardiovascular disorders CIBA-GEIGY CORPORATION (US) 1993-10-05 US disclosed