SCHEMBL11326239

SCHEMBL11326239

c1ccc2c(c1)n1nnnc1c1nnnn21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.53
MEN1 O00255 9/20 0.53
KDM4E B2RXH2 10/20 0.50
MAPT P10636 7/20 0.50
TNKS O95271 5/20 0.50
RAB9A P51151 4/20 0.50
ALDH1A1 P00352 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
HPGD P15428 3/20 0.49
HSD17B10 Q99714 2/20 0.49
NPSR1 Q6W5P4 3/20 0.47
RXFP1 Q9HBX9 2/20 0.47
HTT P42858 3/20 0.46
MAPK1 P28482 2/20 0.46
TSHR P16473 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NPC1 O15118 2/20 0.45
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
NFKB1 P19838 1/20 0.42

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
SCHEMBL6106735 0.76 KDM4E (0.43) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL11868950 0.75 KDM4E (0.54) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL14501908 0.75 MEN1 (0.60) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL8797747 0.75 POLB (0.55) KMT2AMEN1KDM4EMAPTALDH1A1
SCHEMBL7623370 0.75 CUL4A (0.67) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL7623510 0.75 MAPT (0.65) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL11863327 0.75 KDM4E (0.57) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL11870722 0.75 KDM4E (0.64) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL11816931 0.74 MAPT (0.59) KMT2AMEN1KDM4EMAPTTNKS
SCHEMBL4489136 0.72 KMT2A (0.57) KMT2AMEN1KDM4EMAPTTNKS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4258138-A Method of foaming thermoplastic polymeric materials using tetrazole-containing heterocycles THE DOW CHEMICAL COMPANY (US) 1981-03-24 US claimed
US-3988455-A Ditetrazolo(1,5-a:5',1'-c)quinoxalines for control of soil-borne phytopathogens ELI LILLY AND COMPANY (US) 1976-10-26 US claimed
US-4258138-A Method of foaming thermoplastic polymeric materials using tetrazole-containing heterocycles THE DOW CHEMICAL COMPANY (US) 1981-03-24 US disclosed
US-3988455-A Ditetrazolo(1,5-a:5',1'-c)quinoxalines for control of soil-borne phytopathogens ELI LILLY AND COMPANY (US) 1976-10-26 US disclosed
US-3988455-A Ditetrazolo(1,5-a:5',1'-c)quinoxalines for control of soil-borne phytopathogens ELI LILLY AND COMPANY (US) 1976-10-26 US disclosed
US-3988455-A Ditetrazolo(1,5-a:5',1'-c)quinoxalines for control of soil-borne phytopathogens ELI LILLY AND COMPANY (US) 1976-10-26 US disclosed