SCHEMBL8685992

SCHEMBL8685992

O=C1NC(=O)/C(=C/c2cc3ccccc3n2Cc2ccccc2)S1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 2/20 0.51
GAA P10253 2/20 0.51
SI P14410 2/20 0.51
MGAM2 Q2M2H8 2/20 0.51
PARP1 P09874 4/20 0.49
GSK3B P49841 2/20 0.49
PIM1 P11309 1/20 0.49
PIM3 Q86V86 1/20 0.49
PIM2 Q9P1W9 1/20 0.49
MAOA P21397 4/20 0.47
MAOB P27338 4/20 0.47
HPGD P15428 4/20 0.47
POLB P06746 2/20 0.47
PTPN1 P18031 1/20 0.47
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
TTR P02766 1/20 0.46
BLM P54132 1/20 0.46

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
SCHEMBL8685994 1.00 MGAM (0.51) MGAMGAASIMGAM2PARP1
SCHEMBL8686709 0.91 HPGD (0.51) MGAMGAASIMGAM2GSK3B
SCHEMBL8686711 0.91 HPGD (0.51) MGAMGAASIMGAM2GSK3B
SCHEMBL8686000 0.86 KDM4E (0.46) MGAMGAASIMGAM2PARP1
SCHEMBL7244966 0.81 HPGD (0.57) MAOAMAOBHPGDPOLBPTPN1
SCHEMBL7244961 0.81 HPGD (0.57) MAOAMAOBHPGDPOLBPTPN1
SCHEMBL7240861 0.80 PTPN1 (0.56) MAOAMAOBHPGDPOLBPTPN1
SCHEMBL7243257 0.80 HPGD (0.59) MGAMGAASIMGAM2MAOA
SCHEMBL7243253 0.80 HPGD (0.59) MGAMGAASIMGAM2MAOA
SCHEMBL7240866 0.80 PTPN1 (0.56) MAOAMAOBHPGDPOLBPTPN1

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-5811439-A ANTIDIABETIC AGENTS; SIDE EFFECT REDUCTION; ANTILEPEMIC AGENTS SENGA PHARMACEUTICAL LABORATORY INC. (JP) 1998-09-22 US disclosed
EP-0780389-A1 Thiazolidinedione derivatives, process for their preparation and pharmaceutical compositions containing them TOBISHI PHARMACEUTICAL CO., LTD. (JP) 1997-06-25 EP disclosed