SCHEMBL7414211

SCHEMBL7414211

CCOC(=O)CC(CC(=O)OCC)(NC(Cc1ccc(-c2ccccc2)cc1)C(=O)OCc1ccccc1)P(=O)(O)O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
TACR1 P25103 1/20 0.43
MMEL1 Q495T6 1/20 0.42
MAPT P10636 3/20 0.41
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41
HPRT1 P00492 1/20 0.40
ACE P12821 1/20 0.40
GPR34 Q9UPC5 1/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
EED O75530 1/20 0.39
MBTPS1 Q14703 1/20 0.39
ITGB3 P05106 1/20 0.39
ITGAV P06756 1/20 0.39
S1PR1 P21453 1/20 0.39

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
SCHEMBL7414204 1.00 MEN1 (0.43) MEN1KMT2ATACR1MMEL1MAPT
SCHEMBL7413308 0.89 MME (0.46) ACEEEDITGB3ITGAV
SCHEMBL7413316 0.89 MME (0.46) ACEEEDITGB3ITGAV
SCHEMBL7343794 0.83 MMEL1 (0.52) MMEL1
SCHEMBL8921943 0.82 MMEL1 (0.48) MMEL1
SCHEMBL8921959 0.82 MMEL1 (0.48) MMEL1
SCHEMBL8922396 0.81 MME (0.49) MMEL1ACE
SCHEMBL8922371 0.81 MME (0.49) MMEL1ACE
SCHEMBL8923019 0.80 ITGA4 (0.52)
SCHEMBL8923071 0.80 ITGA4 (0.52)

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