SCHEMBL7433371

SCHEMBL7433371

O=C(O)Cc1ccc(NC(=O)c2cccc3ccccc23)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 7/20 1.00
DEGS1 O15121 1/20 0.67
FFAR1 O14842 1/20 0.66
POLB P06746 1/20 0.65
NPC1 O15118 1/20 0.65
RAB9A P51151 1/20 0.65
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
PTGDR2 Q9Y5Y4 3/20 0.60
PLG P00747 2/20 0.58
KLK1 P06870 2/20 0.58
KLK6 Q92876 2/20 0.58
BCAT2 O15382 1/20 0.54

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
SCHEMBL7427460 0.86 NR1H4 (0.76) NR1H4DEGS1NPC1RAB9AMEN1
SCHEMBL7433413 0.85 NR1H4 (0.74) NR1H4DEGS1FFAR1NPC1RAB9A
SCHEMBL368228 0.85 DEGS1 (0.78) NR1H4DEGS1NPC1RAB9AMEN1
SCHEMBL31150345 0.85 DEGS1 (0.78) NR1H4DEGS1NPC1RAB9AMEN1
SCHEMBL18132588 0.82 FFAR1 (0.73) NR1H4FFAR1MEN1KMT2ABCAT2
SCHEMBL26889396 0.82 DEGS1 (0.79) NR1H4DEGS1POLBNPC1RAB9A
SCHEMBL3659132 0.81 DEGS1 (0.72) NR1H4DEGS1FFAR1POLBNPC1
SCHEMBL10102771 0.81 FFAR1 (0.71) NR1H4FFAR1POLBNPC1RAB9A
SCHEMBL7890743 0.80 DEGS1 (1.00) NR1H4DEGS1POLBNPC1RAB9A
SCHEMBL29519104 0.80 DEGS1 (1.00) NR1H4DEGS1POLBNPC1RAB9A

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-2000061631-A1 MODIFIED PENTAPEPTIDE ANTAGONISTS OF THE ATRIAL NATRIURETIC PEPTIDE CLEARANCE RECEPTOR ASTRAZENECA AB (SE) 2000-10-19 WO disclosed