SCHEMBL14249291

SCHEMBL14249291

COc1cc2c(c(O)c1C(=O)/C=C/c1ccc(O)cc1)CCC(C)(C)O2

nearest known ligand 0.78

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NFKB1 P19838 8/20 0.78
▸ NFKB2 Q00653 8/20 0.78
▸ RELA Q04206 8/20 0.78
▸ DPP4 P27487 1/20 0.52
▸ ESR1 P03372 1/20 0.49
▸ PDPK1 O15530 1/20 0.49
▸ TTR P02766 1/20 0.49
▸ ALOX5 P09917 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.48
▸ MAPT P10636 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ ABCG2 Q9UNQ0 2/20 0.47
▸ CAPN1 P07384 1/20 0.46
▸ PARP1 P09874 1/20 0.46
▸ MAOA P21397 1/20 0.46
▸ MAOB P27338 1/20 0.46
▸ PDE4D Q08499 1/20 0.46
▸ MCL1 Q07820 1/20 0.46
▸ CYP19A1 P11511 1/20 0.45

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
SCHEMBL14249292 1.00 NFKB1 (0.78) NFKB1NFKB2RELADPP4ESR1
SCHEMBL31398714 0.93 NFKB1 (0.83) NFKB1NFKB2RELADPP4TDP1
SCHEMBL16166082 0.88 NFKB1 (0.70) NFKB1NFKB2RELATDP1MAPT
SCHEMBL17583534 0.88 NFKB1 (0.70) NFKB1NFKB2RELATDP1MAPT
SCHEMBL16174031 0.87 NFKB1 (0.68) NFKB1NFKB2RELATDP1MAPT
SCHEMBL16166215 0.83 NFKB1 (0.63) NFKB1NFKB2RELAESR1TDP1
SCHEMBL16166213 0.83 NFKB1 (0.63) NFKB1NFKB2RELAESR1TDP1
Xanthohumol B SCHEMBL12961703 0.83 NFKB1 (0.56) NFKB1NFKB2RELADPP4ESR1
Xanthohumol B SCHEMBL29934961 0.83 NFKB1 (0.56) NFKB1NFKB2RELADPP4ESR1
SCHEMBL19221626 0.81 NFKB1 (0.55) NFKB1NFKB2RELADPP4ESR1

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 18 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
US-9956199-B2 Chromane-like cyclic prenylflavonoids for the medical intervention in neurological disorders Aigner, Ludwig (DE) 2018-05-01 — — US disclosed
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
US-20170128411-A1 CHROMANE-LIKE CYCLIC PRENYLFLAVONOIDS FOR THE MEDICAL INTERVENTION IN NEUROLOGICAL DISORDERS Aigner, Ludwig (AT) 2017-05-11 — — US 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
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-9527860-B2 Chromane-like cyclic prenylflavonoids for the medical intervention in neurological disorders Aigner, Ludwig (AT) 2016-12-27 — — US 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
US-20140349919-A1 CHROMANE-LIKE CYCLIC PRENYLFLAVONOIDS FOR THE MEDICAL INTERVENTION IN NEUROLOGICAL DISORDERS COUILLARD-DESPRES, Sébastien (AT) 2014-11-27 — — 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
EP-2720693-A1 CHROMANE-LIKE CYCLIC PRENYLFLAVONOIDS FOR THE MEDICAL INTERVENTION IN NEUROLOGICAL DISORDERS Aigner, Ludwig (AT) 2014-04-23 — — EP disclosed
WO-2012172090-A1 CHROMANE-LIKE CYCLIC PRENYLFLAVONOIDS FOR THE MEDICAL INTERVENTION IN NEUROLOGICAL DISORDERS AIGNER LUDWIG (AT) 2012-12-20 — — WO disclosed
WO-2012172090-A1 CHROMANE-LIKE CYCLIC PRENYLFLAVONOIDS FOR THE MEDICAL INTERVENTION IN NEUROLOGICAL DISORDERS AIGNER LUDWIG (AT) 2012-12-20 — — 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 (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 NFKB1 3784/4885NFKB2 2621/4885RELA 4178/4885
US-20140349919-A1 CHROMANE-LIKE CYCLIC PRENYLFLAVONOIDS FOR THE MEDICAL INTERVENTION IN NEUROLOGICAL DISORDERS BDNF, MAP2, DCX NFKB1 3784/4885NFKB2 2621/4885RELA 4178/4885

“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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