SCHEMBL9167320

SCHEMBL9167320

O=C(c1ccncc1)N1CCC(=C2c3ccccc3CCn3ccnc32)CC1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FNTA P49354 4/20 0.51
FNTB P49356 4/20 0.51
PTAFR P25105 2/20 0.46
HRH1 P35367 2/20 0.44
HPGD P15428 1/20 0.40
NAMPT P43490 4/20 0.39
GAA P10253 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL9167967 0.85 PTAFR (0.64) FNTAFNTBPTAFRHRH1
SCHEMBL18102086 0.82 HRH1 (0.67) FNTAFNTBPTAFRHRH1MEN1
SCHEMBL5060507 0.80 SETD7 (0.59) PTAFRHRH1MEN1KMT2A
SCHEMBL6987747 0.77 HRH1 (0.62) FNTAFNTBPTAFRHRH1MEN1
SCHEMBL6991281 0.76 HRH1 (0.43) FNTAFNTBPTAFRHRH1
SCHEMBL6987948 0.76 HRH1 (0.47) FNTAFNTBPTAFRHRH1
Fumaric Acid SCHEMBL9239444 0.74 MAPK1 (0.45) FNTAFNTBPTAFRHRH1MEN1
SCHEMBL6995295 0.74 HRH1 (0.43) FNTAFNTBPTAFRHRH1
SCHEMBL9129563 0.74 HRH1 (0.41) FNTAFNTBPTAFRHRH1
Fumaric Acid SCHEMBL9239338 0.74 MAPK1 (0.44) FNTAFNTBPTAFRHRH1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0552292-B1 SUBSTITUTED IMIDAZOBENZAZEPINES AND IMIDAZOPYRIDOAZEPINES SCHERING CORP (US) 1995-06-21 EP disclosed
US-5393753-A Antiallergens, antiinflammatory agents SCHERING CORPORATION (US) 1995-02-28 US disclosed
EP-0552292-A1 SUBSTITUTED IMIDAZOBENZAZEPINES AND IMIDAZOPYRIDOAZEPINES. SCHERING CORP (US) 1993-07-28 EP disclosed
WO-1992006981-A1 SUBSTITUTED IMIDAZOBENZAZEPINES AND IMIDAZOPYRIDOAZEPINES SCHERING CORPORATION (US) 1992-04-30 WO disclosed