SCHEMBL16244793

SCHEMBL16244793

COc1cc2c(c(O)c1C(=O)C=Cc1ccc3c(c1)OCO3)C=CC(C)(C)O2

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HIF1AN Q9NWT6 11/20 0.60
▸ ODC1 P11926 2/20 0.60
▸ CYP3A4 P08684 1/20 0.60
▸ CYP2D6 P10635 1/20 0.60
▸ MAPT P10636 1/20 0.60
▸ CYP2C9 P11712 1/20 0.60
▸ CYP2C19 P33261 1/20 0.60
▸ NFKB1 P19838 1/20 0.56
▸ NFKB2 Q00653 1/20 0.56
▸ RELA Q04206 1/20 0.56
▸ ABCG2 Q9UNQ0 1/20 0.54
▸ ACHE P22303 1/20 0.54
▸ PTPN1 P18031 1/20 0.50

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
SCHEMBL16244791 1.00 HIF1AN (0.60) HIF1ANODC1CYP3A4CYP2D6MAPT
SCHEMBL18597279 0.92 NFKB1 (0.62) HIF1ANODC1CYP3A4CYP2D6MAPT
SCHEMBL14325195 0.88 MAPT (0.55) HIF1ANODC1CYP3A4CYP2D6MAPT
SCHEMBL31376169 0.88 HIF1AN (0.65) HIF1ANODC1NFKB1NFKB2RELA
SCHEMBL31376261 0.87 ODC1 (0.75) HIF1ANODC1CYP3A4MAPTNFKB1
SCHEMBL16245064 0.87 HIF1AN (0.67) HIF1ANODC1NFKB1NFKB2RELA
SCHEMBL31376188 0.87 HIF1AN (0.75) HIF1ANODC1CYP3A4MAPTNFKB1
SCHEMBL31376262 0.87 HIF1AN (0.75) HIF1ANODC1CYP3A4MAPTNFKB1
SCHEMBL14315437 0.87 HIF1AN (0.67) HIF1ANODC1NFKB1NFKB2RELA
Xanthohumol C SCHEMBL30066955 0.86 NFKB1 (0.65) HIF1ANODC1NFKB1NFKB2RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9956199-B2 Chromane-like cyclic prenylflavonoids for the medical intervention in neurological disorders Aigner, Ludwig (DE) 2018-05-01 — — US disclosed
EP-3202398-A1 CHROMANE-LIKE CYCLIC PRENYLFLAVONOIDS FOR THE MEDICAL INTERVENTION IN NEUROLOGICAL DISORDERS Aigner, Ludwig (DE) 2017-08-09 — — EP disclosed
US-20170128411-A1 CHROMANE-LIKE CYCLIC PRENYLFLAVONOIDS FOR THE MEDICAL INTERVENTION IN NEUROLOGICAL DISORDERS Aigner, Ludwig (AT) 2017-05-11 — — US disclosed
EP-2720693-B1 CHROMANE-LIKE CYCLIC PRENYLFLAVONOIDS FOR THE MEDICAL INTERVENTION IN NEUROLOGICAL DISORDERS AIGNER LUDWIG (AT) 2017-03-08 — — EP disclosed
US-9527860-B2 Chromane-like cyclic prenylflavonoids for the medical intervention in neurological disorders Aigner, Ludwig (AT) 2016-12-27 — — US disclosed
US-20140349919-A1 CHROMANE-LIKE CYCLIC PRENYLFLAVONOIDS FOR THE MEDICAL INTERVENTION IN NEUROLOGICAL DISORDERS COUILLARD-DESPRES, Sébastien (AT) 2014-11-27 — — 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-20170128411-A1 CHROMANE-LIKE CYCLIC PRENYLFLAVONOIDS FOR THE MEDICAL INTERVENTION IN NEUROLOGICAL DISORDERS BDNF, MAP2, DCX HIF1AN 1645/4885ODC1 4119/4885CYP3A4 4360/4885
US-20140349919-A1 CHROMANE-LIKE CYCLIC PRENYLFLAVONOIDS FOR THE MEDICAL INTERVENTION IN NEUROLOGICAL DISORDERS BDNF, MAP2, DCX HIF1AN 1645/4885ODC1 4119/4885CYP3A4 4360/4885

“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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