SCHEMBL6793796

SCHEMBL6793796

O=[N+]([O-])c1cccnc1Nc1cccc(-c2cncc3ccccc23)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 12/20 0.47
ERN1 O75460 1/20 0.47
MAPT P10636 3/20 0.45
ABL1 P00519 2/20 0.42
CSF1R P07333 1/20 0.42
IGF1R P08069 1/20 0.42
PDGFRB P09619 1/20 0.42
KIT P10721 1/20 0.42
FGFR1 P11362 1/20 0.42
FLT1 P17948 1/20 0.42
FLT4 P35916 1/20 0.42
KDR P35968 1/20 0.42
TEK Q02763 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
PDE5A O76074 1/20 0.41
EGFR P00533 1/20 0.41
BCR P11274 1/20 0.41

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
SCHEMBL6799781 0.89 ABCG2 (0.50) ABCG2MAPTL3MBTL1ALDH1A1MEN1
SCHEMBL6796337 0.81 PRKCZ (0.49) ABCG2ABL1CSF1RIGF1RPDGFRB
SCHEMBL6797321 0.81 MAPT (0.55) ABCG2MAPTL3MBTL1ALDH1A1MEN1
SCHEMBL6797852 0.80 MAPT (0.50) ABCG2MAPTFGFR1L3MBTL1ALDH1A1
SCHEMBL6796955 0.80 ABCG2 (0.53) ABCG2MAPTABL1L3MBTL1ALDH1A1
SCHEMBL6798323 0.80 MAPT (0.54) ABCG2MAPTL3MBTL1ALDH1A1MEN1
SCHEMBL6804477 0.79 MAPT (0.49) ABCG2MAPTL3MBTL1ALDH1A1MEN1
SCHEMBL6804987 0.79 CNR1 (0.47) ABCG2MAPTFGFR1L3MBTL1ALDH1A1
SCHEMBL7357488 0.79 MAPT (0.56) ABCG2MAPTABL1L3MBTL1ALDH1A1
SCHEMBL6795443 0.79 MAPT (0.53) ABCG2MAPTABL1KDRL3MBTL1

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 ABCG2 44/4885ERN1 3660/4885MAPT 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.