SCHEMBL5326341

SCHEMBL5326341

O=C1NC(=O)C(=Cc2ccc3c(c2)c2ccccc2n3C(=O)c2ccccc2)S1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 5/20 0.52
PIM2 Q9P1W9 5/20 0.52
PIM3 Q86V86 1/20 0.52
HPGD P15428 7/20 0.52
AKR1B1 P15121 5/20 0.48
P2RX4 Q99571 1/20 0.48
CISD1 Q9NZ45 2/20 0.45
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
GSK3B P49841 1/20 0.45
RAB9A P51151 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL4781425 0.90 MYC (0.53) PIM1CISD1RAB9A
SCHEMBL4781421 0.90 MYC (0.53) PIM1CISD1RAB9A
SCHEMBL4775888 0.83 PIM1 (0.50) PIM1PIM2PIM3HPGDAKR1B1
SCHEMBL4775890 0.83 PIM1 (0.50) PIM1PIM2PIM3HPGDAKR1B1
SCHEMBL1247641 0.79 PIM1 (0.54) PIM1PIM2PIM3HPGDAKR1B1
SCHEMBL12891939 0.79 PIM1 (0.54) PIM1PIM2PIM3HPGDAKR1B1
SCHEMBL1247642 0.79 PIM1 (0.54) PIM1PIM2PIM3HPGDAKR1B1
SCHEMBL8148705 0.76 MGAM (0.56) PIM1PIM2PIM3HPGD
SCHEMBL8148703 0.76 MGAM (0.56) PIM1PIM2PIM3HPGD
SCHEMBL5320923 0.74 CISD1 (0.51) PIM1CISD1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007119600-A1 CARBAZOLE COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-10-25 WO disclosed