SCHEMBL7540602

SCHEMBL7540602

CC(C)(C)OC(=O)Nc1ccccc1C(N)=O

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.55
ALDH1A1 P00352 2/20 0.55
RXFP1 Q9HBX9 1/20 0.54
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
PKM P14618 2/20 0.50
LMNA P02545 2/20 0.49
POLB P06746 2/20 0.49
TNIK Q9UKE5 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
HPGD P15428 1/20 0.49
PDCD1 Q15116 1/20 0.48
CD274 Q9NZQ7 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
SIRT2 Q8IXJ6 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
SCHEMBL30914161 0.88 RXFP1 (0.52) KDM4EALDH1A1RXFP1MEN1KMT2A
SCHEMBL23259552 0.88 RXFP1 (0.52) KDM4EALDH1A1RXFP1MEN1KMT2A
SCHEMBL18400201 0.87 RXFP1 (0.54) KDM4EALDH1A1RXFP1MEN1KMT2A
SCHEMBL12292165 0.86 RXFP1 (0.53) KDM4EALDH1A1RXFP1MEN1KMT2A
SCHEMBL29663621 0.85 RXFP1 (0.55) KDM4EALDH1A1RXFP1MEN1KMT2A
SCHEMBL29702265 0.85 RXFP1 (0.55) KDM4ERXFP1MEN1KMT2APKM
SCHEMBL15368377 0.85 RXFP1 (0.59) RXFP1MEN1KMT2ALMNAPOLB
SCHEMBL29992092 0.85 RXFP1 (0.59) RXFP1MEN1KMT2ALMNAPOLB
SCHEMBL222446 0.85 RXFP1 (0.55) KDM4ERXFP1MEN1KMT2APKM
SCHEMBL30914162 0.85 RXFP1 (0.50) KDM4EALDH1A1RXFP1MEN1KMT2A

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
EP-0742903-B1 PIPERIDINE ANALOGS AND CONJUGATES OF PROCAINAMIDE AND NAPA ROCHE DIAGNOSTICS CORP (US) 2002-01-16 EP disclosed