SCHEMBL7012199

SCHEMBL7012199

O=C(Nc1ccncc1)c1ccc2cccnc2n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.58
KMT2A Q03164 3/20 0.58
MEN1 O00255 1/20 0.58
LMNA P02545 1/20 0.58
RAB9A P51151 4/20 0.51
NPC1 O15118 3/20 0.51
PRKCI P41743 2/20 0.51
NFKB1 P19838 2/20 0.50
NFKB2 Q00653 2/20 0.50
RELA Q04206 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
JAK2 O60674 3/20 0.48
TYK2 P29597 3/20 0.48
ROCK2 O75116 1/20 0.48
ROCK1 Q13464 1/20 0.48
CYP3A4 P08684 1/20 0.48
JAK1 P23458 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
CD38 P28907 1/20 0.47
CBLB Q13191 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
SCHEMBL7022585 0.90 KDM4E (0.64) KDM4EKMT2AMEN1LMNARAB9A
SCHEMBL7011976 0.86 RAB9A (0.58) KDM4EKMT2AMEN1LMNARAB9A
SCHEMBL7015854 0.79 NPC1 (0.72) KDM4EKMT2AMEN1LMNARAB9A
SCHEMBL5263039 0.78 KDM4E (0.65) KDM4EKMT2AMEN1LMNARAB9A
SCHEMBL7011986 0.77 HSP90AA1 (0.51) KDM4EKMT2AMEN1LMNARAB9A
SCHEMBL22148314 0.77 KMT2A (0.63) KDM4EKMT2AMEN1LMNACYP3A4
SCHEMBL7016457 0.76 NPC1 (0.70) KDM4EKMT2AMEN1LMNARAB9A
SCHEMBL29581099 0.76 NPC1 (0.64) KDM4ELMNARAB9ANPC1SMN1; SMN2
SCHEMBL12469044 0.76 NPC1 (0.64) KDM4ELMNARAB9ANPC1SMN1; SMN2
SCHEMBL6529041 0.76 KDM4E (0.76) KDM4EKMT2AMEN1LMNARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6605614-B2 Anti-hepatitis or anti-herpes BIOCHEM PHARMA INC. (CA) 2003-08-12 US claimed
JP-2002537396-A 2002-11-05 JP claimed
US-20020099072-A1 [1,8] naphthyridine derivatives having antiviral activity BIOCHEM PHARMA INC. 2002-07-25 US claimed
US-6340690-B1 INHIBITING HEPATITIS OR HERPES VIRAL INFECTIONS BIO-CHEM PHARMA INC. (CA) 2002-01-22 US claimed
EP-1155017-A1 [1,8] NAPHTHYRIDINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY Shire Biochem Inc. (CA) 2001-11-21 EP claimed
WO-2000050424-A1 [1,8] NAPHTHYRIDINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY BIOCHEM PHARMA INC. (CA) 2000-08-31 WO claimed
US-6605614-B2 Anti-hepatitis or anti-herpes BIOCHEM PHARMA INC. (CA) 2003-08-12 US disclosed
EP-1155017-B1 [1,8] NAPHTHYRIDINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY SHIRE BIOCHEM INC (CA) 2003-01-15 EP disclosed
US-20020099072-A1 [1,8] naphthyridine derivatives having antiviral activity BIOCHEM PHARMA INC. 2002-07-25 US disclosed
US-6340690-B1 INHIBITING HEPATITIS OR HERPES VIRAL INFECTIONS BIO-CHEM PHARMA INC. (CA) 2002-01-22 US disclosed
EP-1155017-A1 [1,8] NAPHTHYRIDINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY Shire Biochem Inc. (CA) 2001-11-21 EP disclosed
WO-2000050424-A1 [1,8] NAPHTHYRIDINE DERIVATIVES HAVING ANTIVIRAL ACTIVITY BIOCHEM PHARMA INC. (CA) 2000-08-31 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-20020099072-A1 [1,8] naphthyridine derivatives having antiviral activity HAVCR2, MAVS, NTPCR KDM4E 3460/4885KMT2A 4352/4885MEN1 4721/4885

“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.