SCHEMBL8335822

SCHEMBL8335822

NN1C=CN(N)c2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
GAA P10253 2/20 0.36
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
USP2 O75604 1/20 0.33
TP53 P04637 1/20 0.33
HTT P42858 1/20 0.33
TLR9 Q9NR96 1/20 0.33
HTR2A P28223 1/20 0.32
KEAP1 Q14145 1/20 0.32
MGLL Q99685 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX15 P16050 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PIM1 P11309 1/20 0.31
TSHR P16473 2/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL29515039 1.00 KDM4E (0.36) KDM4EGAAKMT2AMEN1USP2
SCHEMBL5047321 0.72
SCHEMBL4838387 0.70 HTR2A (0.36) KMT2AMEN1USP2HTR2AALOX15
SCHEMBL7518490 0.70 LMNA (0.39) SMN1; SMN2TSHRLMNAMAPK1SCN4A
SCHEMBL19976713 0.65 KEAP1 (0.36) KDM4EGAAKMT2AMEN1USP2
SCHEMBL12175881 0.63 CES1 (0.39) KDM4EGAAKMT2AMEN1HTT
SCHEMBL19438835 0.62 TLR9 (0.40) KDM4EGAAKMT2AMEN1USP2
SCHEMBL5894079 0.62 TLR9 (0.35) KDM4EGAAKMT2AMEN1TLR9
SCHEMBL25058991 0.61 MAOA (0.48) KDM4EGAAKMT2AMEN1USP2
SCHEMBL12175889 0.61 LMNA (0.52) GAAHTR2ASMN1; SMN2TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999009845-A1 IMIDAZOQUINOXALINE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-03-04 WO claimed
CN-111808109-B Pyridazine quinoxaline diamine Schiff base cobalt ion fluorescent probe and preparation method thereof 南京林业大学 2022-03-25 CN disclosed
CN-111808109-A Pyridazine quinoxaline diamine Schiff base cobalt ion fluorescent probe and preparation method thereof 南京林业大学 2020-10-23 CN disclosed
EP-3185325-A1 ORGANIC LIGHT-EMITTING DEVICE Samsung Display Co., Ltd. (KR) 2017-06-28 EP disclosed
WO-1999009845-A1 IMIDAZOQUINOXALINE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-03-04 WO disclosed