SCHEMBL29929185

SCHEMBL29929185

COc1c2c(c(C(=O)C=Cc3ccccc3)c(OC)c1Cc1c(O)c(C)c(O)c(C(C)=O)c1O)OC(C)(C)C=C2

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.80
▸ KDM4E B2RXH2 2/20 0.80
▸ MEN1 O00255 2/20 0.80
▸ MAPT P10636 2/20 0.80
▸ KMT2A Q03164 2/20 0.80
▸ TDP1 Q9NUW8 2/20 0.80
▸ NFKB1 P19838 2/20 0.80
▸ USP2 O75604 1/20 0.80
▸ TP53 P04637 1/20 0.80
▸ CYP1A2 P05177 1/20 0.80
▸ CYP3A4 P08684 1/20 0.80
▸ CYP2C9 P11712 1/20 0.80
▸ HPGD P15428 1/20 0.80
▸ ALOX15 P16050 1/20 0.80
▸ ALOX12 P18054 1/20 0.80
▸ CYP2C19 P33261 1/20 0.80
▸ THPO P40225 1/20 0.80
▸ HSD17B10 Q99714 1/20 0.80
▸ EEF2K O00418 1/20 0.80
▸ GMNN O75496 1/20 0.80

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
SCHEMBL29928687 1.00 ALDH1A1 (0.80) ALDH1A1KDM4EMEN1MAPTKMT2A
Rottlerin SCHEMBL29900892 0.89 KDM4E (1.00) ALDH1A1KDM4EMEN1MAPTKMT2A
Rottlerin SCHEMBL29928920 0.89 KDM4E (1.00) ALDH1A1KDM4EMEN1MAPTKMT2A
Rottlerin SCHEMBL148175 0.89 KDM4E (1.00) ALDH1A1KDM4EMEN1MAPTKMT2A
Rottlerin SCHEMBL2524109 0.89 KDM4E (1.00) ALDH1A1KDM4EMEN1MAPTKMT2A
Rottlerin SCHEMBL29584417 0.89 KDM4E (1.00) ALDH1A1KDM4EMEN1MAPTKMT2A
Rottlerin SCHEMBL6694400 0.89 KDM4E (1.00) ALDH1A1KDM4EMEN1MAPTKMT2A
Rottlerin SCHEMBL29772022 0.89 KDM4E (1.00) ALDH1A1KDM4EMEN1MAPTKMT2A
Rottlerin SCHEMBL1537089 0.89 KDM4E (1.00) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL24785845 0.81 KDM4E (0.84) ALDH1A1KDM4EMEN1MAPTKMT2A

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-20250009655-A1 BIPHASIC COMPOSITIONS COMPRISING ONE OR BOTH OF CARBONATE AND PHOSPHATE Natural Extraction Systems, LLC 2025-01-09 — — US claimed
US-20240315965-A1 COMPOSITIONS AND METHODS RELATED TO PHARMACEUTICAL EXCIPIENTS Natural Extraction Systems, LLC (US) 2024-09-26 — — US claimed
WO-2023064318-A1 BIPHASIC COMPOSITIONS COMPRISING ONE OR BOTH OF CARBONATE AND PHOSPHATE Natural Extraction Systems, LLC (US) 2023-04-20 — — WO claimed
WO-2022182527-A1 COMPOSITIONS AND METHODS RELATED TO PHARMACEUTICAL EXCIPIENTS Natural Extraction Systems, LLC (US) 2022-09-01 — — WO claimed
US-12390418-B2 Biphasic compositions comprising one or both of carbonate and phosphate Natural Extraction Systems, LLC (US) 2025-08-19 — — US disclosed
US-20250009655-A1 BIPHASIC COMPOSITIONS COMPRISING ONE OR BOTH OF CARBONATE AND PHOSPHATE Natural Extraction Systems, LLC 2025-01-09 — — US disclosed
WO-2023064318-A1 BIPHASIC COMPOSITIONS COMPRISING ONE OR BOTH OF CARBONATE AND PHOSPHATE Natural Extraction Systems, LLC (US) 2023-04-20 — — WO disclosed
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