SCHEMBL21436734

SCHEMBL21436734

O=C(O)Nc1ccc(NC(=O)COc2ccc(Cl)cc2)s1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
NPC1 O15118 4/20 0.55
RAB9A P51151 4/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
ALDH1A1 P00352 1/20 0.55
SENP2 Q9HC62 1/20 0.55
SENP1 Q9P0U3 1/20 0.55
TSHR P16473 1/20 0.55
MAPT P10636 4/20 0.51
LMNA P02545 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
NPY1R P25929 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ATF4 P18848 3/20 0.50
HPGD P15428 1/20 0.50

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
SCHEMBL21439777 0.94 NPSR1 (0.61) NPSR1MEN1KMT2ANPC1RAB9A
SCHEMBL21436718 0.84 NPSR1 (0.55) NPSR1MEN1KMT2ANPC1RAB9A
SCHEMBL21450365 0.82 MEN1 (0.51) NPSR1MEN1KMT2ANPC1RAB9A
SCHEMBL21436466 0.79 MEN1 (0.53) NPSR1MEN1KMT2ANPC1RAB9A
SCHEMBL21450180 0.78 MAPT (0.68) NPSR1MEN1KMT2ANPC1RAB9A
SCHEMBL16082990 0.77 MEN1 (0.85) NPSR1MEN1KMT2ANPC1RAB9A
SCHEMBL2610071 0.77 MEN1 (0.85) NPSR1MEN1KMT2ANPC1RAB9A
SCHEMBL21450201 0.77 MAPT (0.73) NPSR1MEN1KMT2ANPC1RAB9A
SCHEMBL21436739 0.75 MEN1 (0.60) NPSR1MEN1KMT2ANPC1RAB9A
SCHEMBL21436991 0.74 NPSR1 (0.77) NPSR1MEN1KMT2ANPC1RAB9A

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-2019193540-A1 HETEROARYL DERIVATIVES OF FORMULA (I) AS ATF4 INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-10-10 WO disclosed