SCHEMBL2901859

SCHEMBL2901859

Nc1nc2c(=O)c3ccccc3oc2cc1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TBK1 Q9UHD2 13/20 0.58
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ TTR P02766 3/20 0.49
▸ IKBKE Q14164 8/20 0.47
▸ KDM4E B2RXH2 4/20 0.46
▸ GAA P10253 2/20 0.46
▸ USP2 O75604 1/20 0.46
▸ CSNK2A2 P19784 1/20 0.46
▸ PTGS1 P23219 1/20 0.46
▸ CSNK2B P67870 1/20 0.46
▸ CSNK2A1 P68400 1/20 0.46
▸ CSNK2A3 Q8NEV1 1/20 0.46
▸ MAOB P27338 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ ABCC4 O15439 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ ADRA1A P35348 1/20 0.46
▸ OPRD1 P41143 1/20 0.46
▸ RAB9A P51151 1/20 0.46

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
SCHEMBL11356167 0.88 TBK1 (0.52) TBK1MEN1KMT2ATTRKDM4E
SCHEMBL11544400 0.84 MEN1 (0.68) TBK1MEN1KMT2ATTRKDM4E
SCHEMBL2907889 0.83 TTR (0.54) TBK1MEN1KMT2ATTRIKBKE
SCHEMBL2904833 0.83 KDM4E (0.56) TBK1MEN1KMT2ATTRIKBKE
SCHEMBL2907068 0.82 TTR (0.53) TBK1MEN1KMT2ATTRIKBKE
SCHEMBL2907061 0.82 TTR (0.53) TBK1MEN1KMT2ATTRIKBKE
SCHEMBL2907610 0.82 TBK1 (0.48) TBK1MEN1KMT2ATTRIKBKE
SCHEMBL10511892 0.81 TBK1 (0.76) TBK1MEN1KMT2ATTRIKBKE
SCHEMBL2910718 0.80 KDM4E (0.55) TBK1TTRIKBKEKDM4EGAA
SCHEMBL2907432 0.80 TBK1 (0.56) TBK1TTRIKBKEKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4143042-A ANTIALLERGENS, BRONCHODILATOR AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1979-03-06 — — US claimed
EP-1968981-B1 AZAXANTHONES AND USE THEREOF FOR TREATING TUMORS SUPRATEK PHARMA INC (CA) 2010-08-18 — — EP disclosed
US-7772255-B2 Method of treating tumors with azaxanthones SUPRATEK PHARMA, INC. (CA) 2010-08-10 — — US disclosed
US-20090042923-A1 Method of Treating Tumors with Azaxanthones SEMOV ALEXANDRE 2009-02-12 — — US disclosed
US-20070135473-A1 Method of treating tumors with azaxanthones SUPRATEK PHARMA, INC. 2007-06-14 — — US 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 (2 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-20070135473-A1 Method of treating tumors with azaxanthones S100A4, S100B, S100P TBK1 2135/4885MEN1 602/4885KMT2A 792/4885
US-20090042923-A1 Method of Treating Tumors with Azaxanthones S100A4, S100P, S100B TBK1 2247/4885MEN1 1224/4885KMT2A 976/4885

“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.

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