SCHEMBL7475852

SCHEMBL7475852

Cc1ccc(C(=O)NC2(c3ccccc3)C(=O)NC(=O)NC2=O)cc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.53
MAPT P10636 2/20 0.53
KDM4E B2RXH2 1/20 0.53
APAF1 O14727 1/20 0.53
TDP2 O95551 1/20 0.53
NSD2 O96028 1/20 0.53
GALK1 P51570 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
SAE1 Q9UBE0 1/20 0.53
UBA2 Q9UBT2 1/20 0.53
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
MEN1 O00255 2/20 0.44
RAB9A P51151 4/20 0.42
NPC1 O15118 3/20 0.42
ALDH1A1 P00352 2/20 0.40
NR1H4 Q96RI1 1/20 0.40
GLA P06280 1/20 0.40

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
SCHEMBL7478083 0.85 MAPT (0.47) KMT2AMAPTKDM4EAPAF1TDP2
SCHEMBL7471334 0.84 SMN1; SMN2 (0.52) KMT2AMAPTMEN1RAB9ANPC1
SCHEMBL7483158 0.84 MMP9 (0.41) KMT2AMAPTKDM4EMEN1RAB9A
SCHEMBL7482004 0.83 ALDH1A1 (0.46) KMT2AMAPTKDM4EAPAF1TDP2
SCHEMBL7479933 0.81 ALDH1A1 (0.51) KMT2AMAPTKDM4ESENP7MEN1
SCHEMBL7480698 0.81 AKR1B1 (0.48) KMT2AMAPTKDM4EAPAF1TDP2
SCHEMBL7472363 0.80 L3MBTL1 (0.49) KMT2AMAPTKDM4EAPAF1TDP2
SCHEMBL7477845 0.80 MMP9 (0.42) KMT2AMAPTKDM4EAPAF1TDP2
SCHEMBL7474643 0.80 ALDH1A1 (0.45) KMT2AMAPTKDM4ESENP8SENP7
SCHEMBL7475641 0.80 PTGS2 (0.44) KMT2AMAPTKDM4ECES2CES1

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