SCHEMBL6792926

SCHEMBL6792926

O=[N+]([O-])c1cccnc1Nc1cccc(Oc2ncccn2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.54
KMT2A Q03164 6/20 0.54
MAPT P10636 5/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
JAK2 O60674 1/20 0.50
NPC1 O15118 4/20 0.48
RAB9A P51151 3/20 0.48
MAPK1 P28482 2/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
PKM P14618 1/20 0.47
HTT P42858 1/20 0.47
TLR4 O00206 1/20 0.47
TLR2 O60603 1/20 0.47
ALDH1A1 P00352 3/20 0.46
KCNH2 Q12809 1/20 0.46
ABCG2 Q9UNQ0 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
EGFR P00533 1/20 0.43

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
SCHEMBL6797660 0.89 JAK2 (0.62) MEN1KMT2AMAPTL3MBTL1JAK2
SCHEMBL31157922 0.89 MEN1 (0.54) MEN1KMT2AMAPTL3MBTL1JAK2
SCHEMBL6796123 0.86 MEN1 (0.45) MEN1KMT2AMAPTL3MBTL1JAK2
SCHEMBL31157947 0.84 MAPT (0.44) MEN1KMT2AMAPTL3MBTL1JAK2
SCHEMBL13730771 0.83 MAPT (0.50) MEN1KMT2AMAPTL3MBTL1JAK2
SCHEMBL6799279 0.80 MAPT (0.58) MEN1KMT2AMAPTL3MBTL1NPC1
SCHEMBL7830242 0.80 MAPT (0.61) MEN1KMT2AMAPTL3MBTL1NPC1
SCHEMBL27362918 0.79 MAPT (0.56) MEN1KMT2AMAPTL3MBTL1JAK2
SCHEMBL6796759 0.79 MAPT (0.56) MEN1KMT2AMAPTL3MBTL1NPC1
SCHEMBL6802809 0.79 MAPT (0.56) MEN1KMT2AMAPTL3MBTL1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6727245-B2 4-(HETERO)ARYL-3-OXO-3,4-DIHYDROPYRIDO(2,3-B)PYRAZINE DERIVATIVES; PROPHYLACTIC OR THERAPEUTIC TREATMENT OF PHOSPHODIESTERASE IV AND TUMOR NECROSIS FACTOR MEDIATED DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-04-27 US disclosed
EP-0770079-B1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2003-02-12 EP disclosed
US-20020107251-A1 Heterobicyclic derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-08-08 US disclosed
US-6426345-B1 PHOSPHODIESTERASE INHIBITORS; ANTIINFLAMMATORY AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-07-30 US disclosed
EP-0920867-A1 Pyrido[2,3-a]pyrazine derivatives as PDE-IV and TNF inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-06-09 EP disclosed
EP-0770079-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-02 EP disclosed
WO-1996001825-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-01-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020107251-A1 Heterobicyclic derivatives ARSA, ARRB1, SULT2A1 MEN1 2703/4885KMT2A 968/4885MAPT 4677/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.