SCHEMBL8872080

SCHEMBL8872080

CCOC(=O)CN1C(=O)C(=O)N(Cc2ccccn2)C1=O

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.61
MEN1 O00255 2/20 0.54
ATM Q13315 1/20 0.54
ALDH1A1 P00352 4/20 0.49
PKM P14618 1/20 0.49
KDM4E B2RXH2 1/20 0.48
PTPN1 P18031 1/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PIN1 Q13526 1/20 0.47
PIN4 Q9Y237 1/20 0.47
TSHR P16473 1/20 0.46
ALDH3A1 P30838 1/20 0.46
SMN1; SMN2 Q16637 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
SCHEMBL8873707 0.81 ALDH1A1 (0.56) KMT2AMEN1ALDH1A1PKMKDM4E
SCHEMBL9323818 0.80 KMT2A (0.76) KMT2AMEN1ATMALDH1A1PTPN1
SCHEMBL8872124 0.78 KMT2A (0.65) KMT2AMEN1ATMALDH1A1PTPN1
SCHEMBL9325767 0.78 KMT2A (0.77) KMT2AMEN1ATMALDH1A1PTPN1
SCHEMBL8873587 0.77 KMT2A (0.67) KMT2AMEN1ATMALDH1A1PTPN1
SCHEMBL9323617 0.76 KMT2A (0.73) KMT2AMEN1ATMALDH1A1PTPN1
SCHEMBL9323944 0.75 KMT2A (0.72) KMT2AMEN1ATMALDH1A1KDM4E
SCHEMBL9324908 0.75 KMT2A (0.72) KMT2AMEN1ATMALDH1A1PTPN1
SCHEMBL6978730 0.74 KMT2A (0.70) KMT2AMEN1ATMALDH1A1PTPN1
SCHEMBL6978776 0.74 KMT2A (0.70) KMT2AMEN1ATMALDH1A1PTPN1

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-5681843-A ANTIDIABETIC; ALDOSE REDUCTASE INHIBITOR WITHOUT SUBSTANTIALLY INHIBITING ALDEHYDE REDUCATASE NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1997-10-28 US disclosed
EP-0718289-A1 Novel parabanic acid derivatives as aldose reductase inhibitors NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 1996-06-26 EP disclosed