SCHEMBL2910718

SCHEMBL2910718

COc1ccc2oc3cc(C(=O)O)c(N)nc3c(=O)c2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.55
▸ ALDH1A1 P00352 3/20 0.55
▸ HPGD P15428 3/20 0.55
▸ NPC1 O15118 3/20 0.55
▸ RAB9A P51151 3/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ MAPT P10636 2/20 0.55
▸ CASP3 P42574 1/20 0.55
▸ SENP8 Q96LD8 1/20 0.55
▸ SENP7 Q9BQF6 1/20 0.55
▸ SENP6 Q9GZR1 1/20 0.55
▸ CA12 O43570 2/20 0.49
▸ CA1 P00915 2/20 0.49
▸ CA2 P00918 2/20 0.49
▸ CA3 P07451 2/20 0.49
▸ CA5A P35218 2/20 0.49
▸ CA7 P43166 2/20 0.49
▸ CA9 Q16790 2/20 0.49
▸ CA14 Q9ULX7 2/20 0.49
▸ CA5B Q9Y2D0 2/20 0.49

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
SCHEMBL11545315 0.89 KDM4E (0.56) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL11549538 0.87 KDM4E (0.56) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL11356293 0.86 MAOB (0.54) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL2904833 0.84 KDM4E (0.56) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL2907889 0.82 TTR (0.54) KDM4EALDH1A1NPC1RAB9ACA1
SCHEMBL11544885 0.81 TBK1 (0.72) KDM4ENPC1RAB9ATBK1IKBKE
SCHEMBL2907432 0.81 TBK1 (0.56) KDM4ENPC1RAB9ATBK1IKBKE
SCHEMBL2901850 0.81 TBK1 (0.72) KDM4ENPC1RAB9ATBK1IKBKE
SCHEMBL2907061 0.81 TTR (0.53) KDM4EALDH1A1NPC1RAB9ACA1
SCHEMBL2907068 0.81 TTR (0.53) KDM4EALDH1A1NPC1RAB9ACA1

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 KDM4E 1501/4885ALDH1A1 1500/4885HPGD 1928/4885
US-20090042923-A1 Method of Treating Tumors with Azaxanthones S100A4, S100P, S100B KDM4E 1807/4885ALDH1A1 1535/4885HPGD 1561/4885

“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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