SCHEMBL14397665

SCHEMBL14397665

COc1cc2ccccc2cc1C(=O)NC(C)Cc1ccc(O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.60
MEN1 O00255 7/20 0.60
NPC1 O15118 5/20 0.60
POLB P06746 4/20 0.60
RAB9A P51151 4/20 0.60
KDR P35968 1/20 0.50
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
AHR P35869 2/20 0.48
HPGD P15428 1/20 0.48
ACACB O00763 1/20 0.47
CASP3 P42574 1/20 0.47
ATM Q13315 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL5327174 0.84 ALDH1A1 (0.51) KMT2AMEN1ALDH1A1HTTNPSR1
SCHEMBL14398214 0.84 MEN1 (0.49) KMT2AMEN1NPC1POLBRAB9A
SCHEMBL5324896 0.83 NR1H4 (0.55) KMT2AMEN1ALDH1A1ACACB
SCHEMBL5325179 0.83 NR1H4 (0.55) KMT2AMEN1ALDH1A1ACACB
SCHEMBL5326665 0.83 NR1H4 (0.55) KMT2AMEN1ALDH1A1ACACB
SCHEMBL5325174 0.81 ALDH1A1 (0.70) RAB9AALDH1A1LMNAACACBL3MBTL1
SCHEMBL14398212 0.79 ALDH1A1 (0.48) KMT2AMEN1ALDH1A1HTTACACB
SCHEMBL5325161 0.79 ACACB (0.48) KMT2AMEN1ALDH1A1ACACBL3MBTL1
SCHEMBL5325964 0.77 POLB (0.61) KMT2AMEN1NPC1POLBRAB9A
SCHEMBL14399343 0.77 NPC1 (0.42) KMT2AMEN1NPC1RAB9AKDR

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
WO-2007118964-A1 SUBSTITUTED N-(PHENETHYL)BENZAMIDE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2007-10-25 WO disclosed