SCHEMBL2423910

SCHEMBL2423910

COc1ccc2cc(C(C)O)ccc2c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.66
AKR1C3 P42330 6/20 0.64
AKR1C2 P52895 6/20 0.64
PTGS2 P35354 3/20 0.64
PTGS1 P23219 3/20 0.64
TSHR P16473 2/20 0.64
CYP1A2 P05177 2/20 0.64
CDC42 P60953 1/20 0.64
RAC1 P63000 1/20 0.64
SLC22A6 Q4U2R8 1/20 0.64
UGT2B7 P16662 1/20 0.62
LMNA P02545 1/20 0.60
MAPT P10636 1/20 0.60
CYP2C9 P11712 1/20 0.60
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
CYP11B1 P15538 1/20 0.58
CYP11B2 P19099 1/20 0.58
ALOX5 P09917 2/20 0.55
AKR1C1 Q04828 1/20 0.54

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
SCHEMBL30355290 1.00 ABCB11 (0.66) ABCB11AKR1C3AKR1C2PTGS2PTGS1
SCHEMBL23255697 1.00 ABCB11 (0.66) ABCB11AKR1C3AKR1C2PTGS2PTGS1
SCHEMBL9120097 1.00 ABCB11 (0.66) ABCB11AKR1C3AKR1C2PTGS2PTGS1
SCHEMBL13486840 0.85 CYP11B1 (0.60) ABCB11AKR1C3AKR1C2PTGS2PTGS1
SCHEMBL5610446 0.85 UGT2B7 (0.82) ABCB11AKR1C3AKR1C2PTGS2PTGS1
SCHEMBL13594625 0.85 ABCB11 (0.62) ABCB11AKR1C3AKR1C2PTGS2PTGS1
SCHEMBL20398797 0.83 ABCB11 (0.65) ABCB11AKR1C3AKR1C2PTGS2PTGS1
SCHEMBL487168 0.83 ABCB11 (0.65) ABCB11AKR1C3AKR1C2PTGS2PTGS1
SCHEMBL29365195 0.83 ABCB11 (0.65) ABCB11AKR1C3AKR1C2PTGS2PTGS1
SCHEMBL30640494 0.83 ABCB11 (0.65) ABCB11AKR1C3AKR1C2PTGS2PTGS1

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 108 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116041531-B Brain-targeted anti-angiogenesis polypeptide and nano micelle material thereof 山东大学 2024-06-18 CN claimed
CN-113996338-B Composite photocatalyst and preparation method and application thereof 广东工业大学 2024-01-09 CN claimed
CN-116041531-A Brain-targeted anti-angiogenesis polypeptide and nano micelle material thereof 山东大学 2023-05-02 CN claimed
CN-110078618-B Method for preparing s- (+) naproxen methyl ester by asymmetric catalysis method 常州大学 2022-03-01 CN claimed
CN-113996338-A Composite photocatalyst and preparation method and application thereof 广东工业大学 2022-02-01 CN claimed
US-20170306299-A1 PROTEIN COMPLEX CAPABLE OF CATALYZING ASYMMETRIC OXIDATION REACTION AND METHOD FOR PRODUCING SAME SANYO FOODS CO., LTD. (JP) 2017-10-26 US claimed
US-20150284693-A1 PROTEIN COMPLEX CAPABLE OF CATALYZING ASYMMETRIC OXIDATION REACTION AND METHOD FOR PRODUCING SAME SANYO FOODS CO., LTD. (JP) 2015-10-08 US claimed
EP-2918683-A1 PROTEIN COMPLEX CAPABLE OF CATALYZING ASYMMETRIC OXIDATION REACTION AND METHOD FOR PRODUCING SAME Sanyo Foods Co., Ltd. (JP) 2015-09-16 EP claimed
US-6268526-B1 MIXTURE FORMED FROM AN AROMATIC SUBSTITUTED ALCOHOL AND/OR AN AROMATIC SUBSTITUTED ALKYL HALIDE, AND A COPPER-FREE PALLADIUM CATALYST IS CARBONYLATED WITH CARBON MONOXIDE TO PRODUCE ALPHA-SUBSTITUTED CARBOXYLIC ACID OR ESTER ALBEMARLE CORPORATION 2001-07-31 US claimed
WO-2000035849-A1 PALLADIUM CATALYZED CARBONYLATION PROCESS ALBEMARLE CORPORATION (US) 2000-06-22 WO claimed
JP-59098037-A None JP disclosed
JP-59095239-A None JP disclosed
EP-4520749-A1 DIPHENOLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF Purpana (Beijing) Technologies Co., Ltd (CN) 2025-03-12 EP disclosed
CN-116041531-B Brain-targeted anti-angiogenesis polypeptide and nano micelle material thereof 山东大学 2024-06-18 CN disclosed
WO-2023221665-A1 DIPHENOLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 帕潘纳(北京)科技有限公司 2023-11-23 WO disclosed
EP-0305180-A2 Enantioselective reduction of ketones THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1989-03-01 EP disclosed
EP-0284310-A1 Process for producing ibuprofen HOECHST CELANESE CORPORATION (US) 1988-09-28 EP disclosed
EP-0221677-A2 p-Aminophenols, derivatives thereof and use for manufacture of a medicament E.R. Squibb & Sons, Inc. (US) 1987-05-13 EP disclosed
JP-S5998037-A PREPARATION OF ALPHA-(6-METHOXY-2-NAPHTHYL)PROPIONIC ACID ESTER MITSUBISHI PETROCHEM CO LTD 1984-06-06 JP disclosed
JP-S5995239-A PREPARATION OF ALPHA-(6-METHOXY-2-NAPHTHYL)PROPIONIC ACID MITSUBISHI PETROCHEM CO LTD 1984-06-01 JP disclosed