SCHEMBL6768286

SCHEMBL6768286

CCNC(=O)c1cccc2[nH]c(=O)n(C)c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.44
ALOX5 P09917 2/20 0.43
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.41
DAO P14920 2/20 0.40
CRBN Q96SW2 1/20 0.40
CHIA Q9BZP6 1/20 0.40
CXCR2 P25025 1/20 0.39
KDR P35968 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA2B P29275 1/20 0.39
ADORA1 P30542 1/20 0.39
ADRA1D P25100 2/20 0.38
ADRA1A P35348 2/20 0.38
ADRA1B P35368 2/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
DPP4 P27487 1/20 0.36
PARP1 P09874 1/20 0.36

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
SCHEMBL306633 0.85 CRBN (0.40) BRD4ALOX5KDM4ELMNADAO
SCHEMBL6766587 0.84 DAO (0.43) BRD4KDM4ELMNADAOCRBN
SCHEMBL13015570 0.79 DAO (0.46) KDM4ELMNADAOADORA3ADORA2A
SCHEMBL2084410 0.78 DAO (0.43) BRD4ALOX5KDM4ELMNADAO
SCHEMBL6766709 0.78 PARP1 (0.45) LMNADAOADORA3ADORA2AADORA2B
SCHEMBL25122976 0.74 MEN1 (0.51) LMNADAOADORA3ADORA2AADORA2B
SCHEMBL6772762 0.72 GRM5 (0.54) BRD4ALOX5KDM4ECXCR2KDR
SCHEMBL306634 0.72 DAO (0.40) BRD4LMNADAOADORA3ADORA2A
SCHEMBL13015572 0.72 HPGD (0.46) KDM4EKMT2ATSHRHTT
SCHEMBL9597144 0.72 ALOX5 (0.75) BRD4ALOX5KDM4ECHIACXCR2

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-6699880-B1 STIMULATE MUSCARINIC ACETYLCHOLINE RECEPTORS M4, ANALGESICS BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-03-02 US disclosed
EP-1221443-A1 SUBSTITUTED IMIDAZOLIDINONE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-07-10 EP disclosed