SCHEMBL7366927

SCHEMBL7366927

COC(=O)c1cncc(/C=C/c2cccc(Nc3ncccc3N)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
ABCG2 Q9UNQ0 2/20 0.41
KDM4E B2RXH2 2/20 0.41
ROCK1 Q13464 1/20 0.41
ABL1 P00519 1/20 0.40
BCR P11274 1/20 0.40
SRC P12931 1/20 0.40
MAPK1 P28482 5/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PKM P14618 1/20 0.40
HTT P42858 1/20 0.40
ABCB1 P08183 1/20 0.39
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDR P35968 1/20 0.38
RAF1 P04049 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL7366930 1.00 MAPT (0.41) MAPTABCG2KDM4EROCK1ABL1
SCHEMBL7364781 0.86 SIRT2 (0.49) MAPTABCG2KDM4EMAPK1MEN1
SCHEMBL7364785 0.86 SIRT2 (0.49) MAPTABCG2KDM4EMAPK1MEN1
SCHEMBL7364788 0.86 SIRT2 (0.49) MAPTABCG2KDM4EMAPK1MEN1
SCHEMBL7361062 0.85 MAPK1 (0.52) MAPTMAPK1MEN1KMT2AALDH1A1
SCHEMBL7361064 0.85 MAPK1 (0.52) MAPTMAPK1MEN1KMT2AALDH1A1
SCHEMBL7367401 0.81 NPC1 (0.49) MAPTROCK1MEN1KMT2AHTT
SCHEMBL7367405 0.81 NPC1 (0.49) MAPTROCK1MEN1KMT2AHTT
SCHEMBL7367396 0.81 NPC1 (0.49) MAPTROCK1MEN1KMT2AHTT
SCHEMBL6793312 0.80 TLR4 (0.47) MAPTABCG2ABL1BCRSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0874845-B1 PYRIDO (2,3-B) PYRAZINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2002-03-06 EP disclosed
US-6117875-A Pyrido (2,3-B) pyrazine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-09-12 US disclosed
EP-0874845-A1 PYRIDO (2,3-B) PYRAZINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-11-04 EP disclosed
WO-1997024355-A1 PYRIDO (2,3-B) PYRAZINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-07-10 WO disclosed