SCHEMBL6793329

SCHEMBL6793329

O=[N+]([O-])c1cccnc1Nc1cccc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.62
KMT2A Q03164 6/20 0.62
L3MBTL1 Q9Y468 3/20 0.62
ALDH1A1 P00352 5/20 0.53
PDE10A Q9Y233 1/20 0.51
MAPT P10636 6/20 0.50
POLB P06746 1/20 0.50
MDM4 O15151 1/20 0.49
NFKBIA P25963 1/20 0.49
OPRK1 P41145 1/20 0.49
MDM2 Q00987 1/20 0.49
RELA Q04206 1/20 0.49
SLC40A1 Q9NP59 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
ABCG2 Q9UNQ0 1/20 0.48
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NCOA1 Q15788 1/20 0.47

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
SCHEMBL29695604 0.81 MEN1 (0.56) MEN1KMT2AALDH1A1MAPTTDP1
SCHEMBL12100921 0.81 MEN1 (0.56) MEN1KMT2AL3MBTL1ALDH1A1PDE10A
SCHEMBL4940897 0.81 ALDH1A1 (0.65) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL9403354 0.80 MEN1 (0.52) MEN1KMT2AL3MBTL1MAPTRAB9A
SCHEMBL11901236 0.80 KMT2A (0.69) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL13506822 0.80 L3MBTL1 (0.65) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL11551932 0.80 MEN1 (0.65) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL21049187 0.80 MEN1 (0.52) MEN1KMT2AL3MBTL1ALDH1A1PDE10A
Ammonia Solution, Strong SCHEMBL27766738 0.79 ALDH1A1 (0.62) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL6799781 0.78 ABCG2 (0.50) MEN1KMT2AL3MBTL1ALDH1A1PDE10A

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 10 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
CN-1051548-C Heterobicyclic derivatives, pharmaceutical compositions containing them, process for preparing them and their use FUJISAWA PHARMACEUTICAL CO (JP) 2000-04-19 CN disclosed
CN-1250776-A Heterodicyclic compound derivatives FUJISAWA PHARMACEUTICAL CO (JP) 2000-04-19 CN 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
CN-1157617-A Heterobicyclic derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1997-08-20 CN 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 968/4885L3MBTL1 1987/4885

“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.