SCHEMBL7380264

SCHEMBL7380264

O=C(O)c1ccc(NC(=O)[C@H](Cc2ccccc2)OP(=O)(O)OCCc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HDAC1 Q13547 3/20 0.40
HDAC2 Q92769 1/20 0.40
F9 P00740 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ROCK2 O75116 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
MAPT P10636 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
FFAR1 O14842 1/20 0.38

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
SCHEMBL7383128 0.88 MAPT (0.53) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL7382129 0.88 FPR2 (0.46) MEN1KMT2AHDAC1HDAC2NPC1
SCHEMBL7381948 0.85 CYP1A2 (0.46) MEN1KMT2AF9NPC1RAB9A
SCHEMBL7376508 0.84 MEN1 (0.42) MEN1KMT2AHDAC1HDAC2F9
SCHEMBL7298373 0.83 KMT2A (0.45) MEN1KMT2ANPC1RAB9ACYP1A2
SCHEMBL7298366 0.83 KMT2A (0.45) MEN1KMT2ANPC1RAB9ACYP1A2
SCHEMBL7291448 0.83 ACE (0.44) MEN1KMT2AHDAC1HDAC2HDAC8
SCHEMBL7291457 0.83 ACE (0.44) MEN1KMT2AHDAC1HDAC2HDAC8
SCHEMBL7377136 0.82 MEN1 (0.44) MEN1KMT2AHDAC2NPC1RAB9A
SCHEMBL10522272 0.82 KMT2A (0.44) MEN1KMT2ANPC1RAB9ACYP1A2

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