SCHEMBL7365124

SCHEMBL7365124

CC(C)(C)C(=O)OCOC(=O)CCNC(=O)C(Cc1ccccc1)CP(=O)(O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.48
ECE1 P42892 2/20 0.48
HRH4 Q9H3N8 1/20 0.46
ACE P12821 2/20 0.46
ENPEP Q07075 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ABCC3 O15438 1/20 0.41
NR1I2 O75469 1/20 0.41
ABCB11 O95342 1/20 0.41
NR3C1 P04150 1/20 0.41
RARG P13631 1/20 0.41
CNR1 P21554 1/20 0.41
OPRK1 P41145 1/20 0.41
NR1H2 P55055 1/20 0.41
PPARA Q07869 1/20 0.41
NR1H3 Q13133 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
SCHEMBL7316396 0.85 MME (0.53) MMEECE1HRH4ACECYP3A4
SCHEMBL10790828 0.84 MME (0.52) MMEECE1HRH4ACECYP3A4
SCHEMBL7432294 0.83 HRH4 (0.54) MMEECE1HRH4ACECYP1A2
SCHEMBL7432306 0.83 HRH4 (0.54) MMEECE1HRH4ACECYP1A2
SCHEMBL10710869 0.81 ACE (0.59) MMEACEMMEL1
SCHEMBL7437675 0.81 ACE (0.59) MMEACEMMEL1
SCHEMBL7368050 0.81 MME (0.50) MMEECE1HRH4ACE
SCHEMBL10790695 0.81 MME (0.50) MMEECE1HRH4ACE
SCHEMBL10789536 0.80 MME (0.49) MMEECE1HRH4ACEMMEL1
SCHEMBL7318461 0.79 ACE (0.70) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0117429-B1 PHOSPHOROUS CONTAINING COMPOUNDS AS INHIBITORS OF ENKEPHALINASES SCHERING CORPORATION (US) 1987-09-02 EP claimed
EP-0117429-A1 Phosphorous containing compounds as inhibitors of enkephalinases SCHERING CORPORATION (US) 1984-09-05 EP claimed
EP-0117429-B1 PHOSPHOROUS CONTAINING COMPOUNDS AS INHIBITORS OF ENKEPHALINASES SCHERING CORPORATION (US) 1987-09-02 EP disclosed
EP-0117429-A1 Phosphorous containing compounds as inhibitors of enkephalinases SCHERING CORPORATION (US) 1984-09-05 EP disclosed