SCHEMBL9703688

SCHEMBL9703688

COc1nc2cc(Cl)c(Cl)cc2nc1C(=O)NC(=O)Nc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.45
RAB9A P51151 5/20 0.45
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
ATM Q13315 1/20 0.45
POLB P06746 2/20 0.44
PKM P14618 1/20 0.44
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
RCE1 Q9Y256 1/20 0.41
SMO Q99835 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41

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
SCHEMBL15958629 0.78 MAPT (0.54) MAPT
SCHEMBL9703856 0.76 GRIN2D (0.49) MEN1KMT2APOLBLMNASMN1; SMN2
SCHEMBL9704050 0.75 GRIN2D (0.62) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL9703955 0.70 HRH4 (0.43) RAB9APOLBLMNASMN1; SMN2ALDH1A1
SCHEMBL15945345 0.67 MAPT (0.55) NPC1RAB9AMEN1KMT2APOLB
SCHEMBL31137919 0.67 ALDH1A1 (0.67) MEN1KMT2APOLBSMN1; SMN2ALDH1A1
SCHEMBL5717618 0.67 ALDH1A1 (0.67) MEN1KMT2APOLBSMN1; SMN2ALDH1A1
SCHEMBL22093214 0.66 KDM4E (0.52) NPC1RAB9AMEN1KMT2AATM
SCHEMBL7605864 0.66 KMT2A (0.61) NPC1RAB9AMEN1KMT2APOLB
SCHEMBL11342623 0.66 SMN1; SMN2 (0.59) NPC1RAB9AMEN1KMT2APOLB

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-1992011245-A1 2-ACYLAMIDO DERIVATIVES OF 3,4-DIHYDRO-3-OXO-QUINOXALINE HAVING PHARMACEUTICAL ACTIVITY WARNER-LAMBERT COMPANY (US) 1992-07-09 WO disclosed