SCHEMBL7472887

SCHEMBL7472887

O=C1NC(=O)C(NC(=O)c2cccc(Br)c2)(c2ccccc2)C(=O)N1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
SMN1; SMN2 Q16637 5/20 0.48
GAA P10253 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
NPC1 O15118 4/20 0.46
RAB9A P51151 3/20 0.45
MAPT P10636 4/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
POLB P06746 1/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ATM Q13315 1/20 0.42

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
SCHEMBL7482004 0.86 ALDH1A1 (0.46) ALDH1A1GAAMAPTLMNAMEN1
SCHEMBL7472363 0.85 L3MBTL1 (0.49) ALDH1A1SMN1; SMN2RAB9AMAPTMEN1
SCHEMBL7474643 0.85 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL7482260 0.84 KCNA3 (0.48) ALDH1A1SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL7471334 0.84 SMN1; SMN2 (0.52) ALDH1A1SMN1; SMN2NPSR1NPC1RAB9A
SCHEMBL7476927 0.82 HDAC8 (0.55) ALDH1A1SMN1; SMN2NPC1RAB9ALMNA
SCHEMBL7483118 0.81 NR1H4 (0.44) SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL7478056 0.81 KMT2A (0.46) ALDH1A1SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL7480996 0.81 RAB9A (0.56) ALDH1A1SMN1; SMN2NPSR1NPC1RAB9A
SCHEMBL7478227 0.81 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2NPSR1NPC1RAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6472396-B1 Barbituric acid derivatives, processes for their production and pharmaceutical agents containing these compounds ROCHE DIAGNOSTICS GMBH (DE) 2002-10-29 US claimed
EP-0869947-B1 BARBITURIC ACID DERIVATIVES, PROCESSES FOR THEIR PRODUCTION AND PHARMACEUTICAL AGENTS CONTAINING THESE COMPOUNDS ROCHE DIAGNOSTICS GMBH (DE) 2002-10-23 EP disclosed