SCHEMBL2907889

SCHEMBL2907889

Nc1nc2c(=O)c3cc(Cl)ccc3oc2cc1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 3/20 0.54
▸ NPC1 O15118 2/20 0.54
▸ RAB9A P51151 2/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ TBK1 Q9UHD2 14/20 0.51
▸ ALDH1A1 P00352 2/20 0.49
▸ IKBKE Q14164 8/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ GPR35 Q9HC97 2/20 0.48
▸ ABCC4 O15439 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ ADRA1A P35348 1/20 0.48
▸ OPRD1 P41143 1/20 0.48
▸ PDE4D Q08499 1/20 0.48
▸ PDE3A Q14432 1/20 0.48
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ L3MBTL1 Q9Y468 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
SCHEMBL2907061 0.99 TTR (0.53) TTRNPC1RAB9AMEN1KMT2A
SCHEMBL2907068 0.99 TTR (0.53) TTRNPC1RAB9AMEN1KMT2A
SCHEMBL11365313 0.90 KDM4E (0.49) TTRNPC1RAB9AMEN1KMT2A
SCHEMBL2907058 0.88 TTR (0.46) TTRNPC1RAB9AMEN1KMT2A
SCHEMBL11356857 0.86 TTR (0.56) TTRNPC1RAB9AMEN1KMT2A
SCHEMBL11549501 0.85 MEN1 (0.70) TTRNPC1RAB9AMEN1KMT2A
SCHEMBL2904833 0.85 KDM4E (0.56) TTRNPC1RAB9AMEN1KMT2A
SCHEMBL2901859 0.83 TBK1 (0.58) TTRNPC1RAB9AMEN1KMT2A
SCHEMBL11108156 0.83 MAOB (0.56) TTRNPC1RAB9AMEN1KMT2A
SCHEMBL2907432 0.82 TBK1 (0.56) TTRNPC1RAB9ATBK1IKBKE

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-20090042923-A1 Method of Treating Tumors with Azaxanthones SEMOV ALEXANDRE 2009-02-12 — — US claimed
US-20070135473-A1 Method of treating tumors with azaxanthones SUPRATEK PHARMA, INC. 2007-06-14 — — US claimed
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 TTR 1926/4885NPC1 4456/4885RAB9A 2400/4885
US-20090042923-A1 Method of Treating Tumors with Azaxanthones S100A4, S100P, S100B TTR 1495/4885NPC1 4429/4885RAB9A 1986/4885

“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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