Alterporriol C

Alterporriol C

SCHEMBL29359613

COc1cc(O)c2c(c1)C(=O)c1cc(C)c(O)c(-c3c(OC)cc4c(c3O)C(=O)C3=C(C4=O)[C@@H](O)[C@](C)(O)[C@H](O)[C@H]3O)c1C2=O

nearest known ligand 0.70

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NFKB1 P19838 2/20 0.70
▸ NFKB2 Q00653 2/20 0.70
▸ RELA Q04206 2/20 0.70
▸ ELANE P08246 4/20 0.45
▸ ALDH1A1 P00352 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ ALOX15 P16050 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ EPHX2 P34913 6/20 0.40
▸ IDO1 P14902 1/20 0.39
▸ PARP1 P09874 4/20 0.38
▸ PTPN1 P18031 4/20 0.38
▸ ACLY P53396 2/20 0.38
▸ CYP1A2 P05177 2/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ EGFR P00533 1/20 0.35
▸ CDK4 P11802 1/20 0.35
▸ CCND1 P24385 1/20 0.35

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
SCHEMBL29359665 0.91 NFKB1 (0.55) NFKB1NFKB2RELAELANEMAPT
Alterporriol P SCHEMBL29360385 0.85 NFKB1 (0.49) NFKB1NFKB2RELAELANEALDH1A1
SCHEMBL23522374 0.85 NFKB1 (0.59) NFKB1NFKB2RELAELANEALDH1A1
SCHEMBL29362349 0.85 NFKB1 (0.59) NFKB1NFKB2RELAELANEALDH1A1
Altersolanol A SCHEMBL29845341 0.84 NFKB1 (1.00) NFKB1NFKB2RELAELANEALDH1A1
Altersolanol A SCHEMBL14923292 0.84 NFKB1 (1.00) NFKB1NFKB2RELAELANEALDH1A1
Altersolanol A SCHEMBL29688970 0.84 NFKB1 (1.00) NFKB1NFKB2RELAELANEALDH1A1
Altersolanol A SCHEMBL8734898 0.84 NFKB1 (1.00) NFKB1NFKB2RELAELANEALDH1A1
Altersolanol A SCHEMBL2793105 0.84 NFKB1 (1.00) NFKB1NFKB2RELAELANEALDH1A1
Alterporriol G/H SCHEMBL15338594 0.82 NFKB1 (0.55) NFKB1NFKB2RELAELANEEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3943085-A2 TOMM6-INTERACTING EXTRACTS AND COMPOUNDS FOR USE IN THE TREATMENT AND PROPHYLAXIS OF NERVOUS SYSTEM DISEASES, ATHEROSCLEROSIS, HEPATITIS B INFECTION AND HUMAN PAPILLOMA VIRUS (HPV) INFECTION ETH Zurich (CH) 2022-01-26 — — EP claimed
EP-3943085-A2 TOMM6-INTERACTING EXTRACTS AND COMPOUNDS FOR USE IN THE TREATMENT AND PROPHYLAXIS OF NERVOUS SYSTEM DISEASES, ATHEROSCLEROSIS, HEPATITIS B INFECTION AND HUMAN PAPILLOMA VIRUS (HPV) INFECTION ETH Zurich (CH) 2022-01-26 — — EP disclosed
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