SCHEMBL5680327

SCHEMBL5680327

NC(=O)[C@H](NCCc1ccc(Oc2ccccc2)cc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.52
LTA4H P09960 3/20 0.52
OPRM1 P35372 1/20 0.52
OPRD1 P41143 1/20 0.52
OPRK1 P41145 1/20 0.52
KMT2A Q03164 2/20 0.52
FFAR1 O14842 1/20 0.51
PLAAT3 P53816 2/20 0.51
PLAAT5 Q96KN8 2/20 0.51
PLAAT2 Q9NWW9 2/20 0.51
PLAAT4 Q9UL19 2/20 0.51
HAT1 O14929 4/20 0.49
EP300 Q09472 4/20 0.49
BLM P54132 1/20 0.49
SLC2A1 P11166 1/20 0.48

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
SCHEMBL5681613 1.00 EPHX2 (0.52) EPHX2LTA4HOPRM1OPRD1OPRK1
SCHEMBL5680330 1.00 EPHX2 (0.52) EPHX2LTA4HOPRM1OPRD1OPRK1
SCHEMBL5684469 0.91 ULK1 (0.51) EPHX2LTA4HOPRM1OPRD1OPRK1
SCHEMBL5695724 0.91 ULK1 (0.51) EPHX2LTA4HOPRM1OPRD1OPRK1
SCHEMBL5684479 0.91 ULK1 (0.51) EPHX2LTA4HOPRM1OPRD1OPRK1
SCHEMBL5697044 0.89 ADRB3 (0.56) EPHX2LTA4HKMT2AHAT1EP300
SCHEMBL5695684 0.89 FNTA (0.50) EPHX2LTA4HOPRM1OPRD1OPRK1
SCHEMBL5684079 0.89 FNTA (0.50) EPHX2LTA4HOPRM1OPRD1OPRK1
SCHEMBL5697043 0.89 ADRB3 (0.56) EPHX2LTA4HKMT2AHAT1EP300
SCHEMBL5682167 0.84 LTA4H (0.46) EPHX2LTA4HOPRM1KMT2AFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1044186-B9 SUBSTITUTED 2-BENZYLAMINO-2-PHENYL-ACETAMIDE COMPOUNDS NEWRON PHARM SPA (IT) 2006-06-21 EP disclosed
EP-1044186-B1 SUBSTITUTED 2-BENZYLAMINO-2-PHENYL-ACETAMIDE COMPOUNDS NEWRON PHARM SPA (IT) 2006-03-08 EP disclosed