SCHEMBL7365724

SCHEMBL7365724

O=C(O)C(CNC(=O)C(Cc1ccccc1)CP(=O)(O)O)Cc1nc2ccccc2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 6/20 0.48
GAA P10253 2/20 0.44
CHRM1 P11229 1/20 0.44
TSHR P16473 1/20 0.42
MAPK10 P53779 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MMP1 P03956 1/20 0.42
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
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
HTT P42858 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
SCHEMBL7367028 0.83 FOLH1 (0.55) CYP1A2
SCHEMBL7362963 0.78 CYP1A2 (0.47) GAACYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL7440491 0.78 FOLH1 (0.51) CYP1A2
SCHEMBL7361616 0.77 FOLH1 (0.48) CYP1A2
SCHEMBL7365235 0.76 MME (0.54) TSHRSMN1; SMN2CYP3A4
SCHEMBL7367466 0.75 ANPEP (0.47) MMP1CYP1A2
SCHEMBL7361620 0.74 FOLH1 (0.45) CYP1A2
SCHEMBL7363389 0.74 FOLH1 (0.49) CYP1A2
SCHEMBL7364484 0.73 ANPEP (0.50)
SCHEMBL7366262 0.72 LTA4H (0.48)

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