SCHEMBL7382129

SCHEMBL7382129

CCOP(=O)(O)O[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.46
NPY1R P25929 1/20 0.43
NPY2R P49146 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 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
SMN1; SMN2 Q16637 3/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.40
GAA P10253 1/20 0.40
HDAC3 O15379 3/20 0.40
HDAC4 P56524 3/20 0.40
HDAC1 Q13547 3/20 0.40
HDAC7 Q8WUI4 3/20 0.40

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
SCHEMBL7386048 0.88 FPR2 (0.48) FPR2NPY1RNPY2RNPC1RAB9A
SCHEMBL7380264 0.88 MEN1 (0.41) NPC1RAB9AMEN1KMT2ACYP1A2
SCHEMBL7298366 0.86 KMT2A (0.45) NPY1RNPY2RNPC1RAB9AMEN1
SCHEMBL7298373 0.86 KMT2A (0.45) NPY1RNPY2RNPC1RAB9AMEN1
SCHEMBL7381948 0.86 CYP1A2 (0.46) NPC1RAB9AMEN1KMT2ACYP1A2
SCHEMBL7383064 0.85 FPR2 (0.46) FPR2NPY1RNPY2RNPC1RAB9A
SCHEMBL10522272 0.85 KMT2A (0.44) NPY1RNPY2RNPC1RAB9AMEN1
SCHEMBL7383121 0.83 TDP1 (0.45) NPY1RNPY2RNPC1RAB9AMEN1
SCHEMBL7377136 0.83 MEN1 (0.44) NPC1RAB9AMEN1KMT2ACYP1A2
SCHEMBL7383128 0.83 MAPT (0.53) NPC1RAB9AMEN1KMT2ASMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4853476-A Phosphorus containing compounds as inhibitors of enkephalinases SCHERING CORPORATION (US) 1989-08-01 US disclosed