SCHEMBL9733116

SCHEMBL9733116

c1ccc(C2C3=NCCCN3CCc3ccccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRCP P42785 4/20 0.42
LMNA P02545 2/20 0.40
GAA P10253 2/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
ALOX12 P18054 1/20 0.40
CHRNA7 P36544 1/20 0.37
CYP11B2 P19099 1/20 0.35
SIGMAR1 Q99720 3/20 0.35
HDAC8 Q9BY41 1/20 0.34
DRD1 P21728 1/20 0.33

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
SCHEMBL9731265 0.92 PRCP (0.44) PRCPLMNAGAATP53HPGD
SCHEMBL9732546 0.71 CA1 (0.39) SIGMAR1DRD1
SCHEMBL1143328 0.69 GAA (0.59) PRCPLMNAGAATP53HPGD
SCHEMBL9732352 0.65 INMT (0.47) LMNASIGMAR1DRD1
SCHEMBL9730970 0.64 PRCP (0.46) PRCPLMNAGAATP53HPGD
SCHEMBL1722733 0.62 GAA (0.51) PRCPLMNAGAATP53HPGD
SCHEMBL6860623 0.61 HSD11B1 (0.43) LMNA
SCHEMBL11166800 0.61 SLC6A2 (0.53) PRCPLMNASIGMAR1DRD1
SCHEMBL809801 0.60 STAT3 (0.38)
SCHEMBL9629222 0.60 PRCP (0.51) PRCPHDAC8

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-5106844-A Imidazo[2,2-b][3]benzazepine and pyrimido[2,1-b][3]benzazepine antiarrhythmic agents STERLING DRUG INC. (US) 1992-04-21 US claimed
US-5106844-A Imidazo[2,2-b][3]benzazepine and pyrimido[2,1-b][3]benzazepine antiarrhythmic agents STERLING DRUG INC. (US) 1992-04-21 US disclosed