SCHEMBL1004416

SCHEMBL1004416

COc1ccc2ccccc2c1B(O)O

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.58
KDM4E B2RXH2 1/20 0.50
HPGD P15428 1/20 0.50
NQO1 P15559 1/20 0.47
ENPP2 Q13822 1/20 0.47
ORAI1 Q96D31 1/20 0.46
ORAI2 Q96SN7 1/20 0.46
ORAI3 Q9BRQ5 1/20 0.46
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NISCH Q9Y2I1 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL29517404 1.00 MAPT (0.58) MAPTKDM4EHPGDNQO1ENPP2
SCHEMBL2202982 0.82 ALDH1A1 (0.49) MAPTKDM4EHPGDENPP2ORAI1
SCHEMBL7675242 0.82 MAPT (0.42) MAPTKDM4EHPGD
SCHEMBL21223556 0.81 MAPT (0.54) MAPTKDM4EHPGDCYP1A2CYP2C9
SCHEMBL1642006 0.81 ALOX5 (0.50) MAPTKDM4EHPGD
SCHEMBL29956903 0.81 ALOX5 (0.50) MAPTKDM4EHPGD
SCHEMBL15330334 0.80 KDM1A (0.42) MAPTKDM4EHPGDMEN1KMT2A
SCHEMBL28798247 0.80 IDO1 (0.42) MAPTKDM4EHPGDNQO1ENPP2
SCHEMBL2558327 0.79 GAA (0.43) MAPTCYP2C9
SCHEMBL25201352 0.79 MEN1 (0.41) MAPTKDM4EHPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117865773-A Preparation method of difluoromethyl aromatic compound based on palladium-catalyzed decarbonylation coupling 大连理工大学 2024-04-12 CN claimed
CN-109305981-B Synthesis method of 2-hydroxynaphthalene-1-boric acid 白银棓诺新材料有限公司 2021-10-29 CN claimed
US-6800784-B1 REACTING AROMATIC COMPOUND CARRYING AT LEAST ONE AMINO GROUP AND LEAVING GROUP WITH ARYLBORONIC ACID OR DERIVATIVE THEREOF, IN AQUEOUS MEDIUM, AND IN PRESENCE OF EFFECTIVE QUANTITY OF PALLADIUM CATALYST RHODIA CHIMIE (FR) 2004-10-05 US claimed
US-6590100-B2 Reacting an aromatic compound bearing a leaving group and an arylboronic acid and/or its derivatives in the presence of a base and an effective amount of a nickel catalyst RHODIA CHIMIE (FR) 2003-07-08 US claimed
US-20020173652-A1 Process for preparing a polyaromatic compound SHASUN PHARMA SOLUTIONS, INC. 2002-11-21 US claimed
US-20260096277-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING SAME LT MATERIALS CO., LTD. (KR) 2026-04-02 US disclosed
US-12410180-B2 Light-emitting device, light-emitting apparatus, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2025-09-09 US disclosed
US-20250188073-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS INCYTE CORP (US) 2025-06-12 US disclosed
EP-4548918-A2 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS Incyte Corporation (US) 2025-05-07 EP disclosed
US-20250115614-A1 Organic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2025-04-10 US disclosed
CN-119661592-A Monophosphine ligand oEPCP containing [2.2] p-cycloalkane skeleton structure, and preparation method and application thereof 中国人民解放军海军军医大学 2025-03-21 CN disclosed
US-12234244-B2 Substituted piperazines as inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2025-02-25 US disclosed
US-20050065350-A1 Method for forming a carbon-carbon or carbon-heteroatom linkage SHASUN PHARMA SOLUTIONS, INC. 2005-03-24 US disclosed
US-6800784-B1 REACTING AROMATIC COMPOUND CARRYING AT LEAST ONE AMINO GROUP AND LEAVING GROUP WITH ARYLBORONIC ACID OR DERIVATIVE THEREOF, IN AQUEOUS MEDIUM, AND IN PRESENCE OF EFFECTIVE QUANTITY OF PALLADIUM CATALYST RHODIA CHIMIE (FR) 2004-10-05 US disclosed
US-20030236413-A1 Catalysis in presence of a metallic element, an imine ligand and nitrogen compound as chelating compound, forming a chemical intermediates in the agrochemical and pharmaceutical fields SHASUN PHARMA SOLUTIONS, INC. 2003-12-25 US disclosed
US-20030171593-A1 Process for arylating or vinylating or alkynating a nucleophilic compound SHASUN PHARMA SOLUTIONS, INC. 2003-09-11 US disclosed
US-6590100-B2 Reacting an aromatic compound bearing a leaving group and an arylboronic acid and/or its derivatives in the presence of a base and an effective amount of a nickel catalyst RHODIA CHIMIE (FR) 2003-07-08 US disclosed
US-20020173652-A1 Process for preparing a polyaromatic compound SHASUN PHARMA SOLUTIONS, INC. 2002-11-21 US disclosed
US-20020049316-A1 Protease inhibitors HALBERT STACIE MARIE (US) 2002-04-25 US disclosed
WO-1995013284-A1 ASYMMETRIC HYDROBORATION ISIS INNOVATION LIMITED (GB) 1995-05-18 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 (10 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-20050065350-A1 Method for forming a carbon-carbon or carbon-heteroatom linkage COX6C, CBR3, CBR1 MAPT 3391/4885KDM4E 1884/4885HPGD 669/4885
US-20250115614-A1 Organic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device NDUFC1, ARNT, NFE2L2 MAPT 2498/4885KDM4E 3990/4885HPGD 1369/4885
US-20030236413-A1 Catalysis in presence of a metallic element, an imine ligand and nitrogen compound as chelating compound, forming a chemical intermediates in the agrochemical and pharmaceutical fields ALK, INMT, ACHE MAPT 3435/4885KDM4E 990/4885HPGD 2820/4885
US-20020049316-A1 Protease inhibitors CTSK, CTSZ, CTSG MAPT 796/4885KDM4E 3001/4885HPGD 392/4885
US-12234244-B2 Substituted piperazines as inhibitors of KRAS G12C KRAS, NRAS, HRAS MAPT 229/4885KDM4E 2534/4885HPGD 4385/4885
US-20030171593-A1 Process for arylating or vinylating or alkynating a nucleophilic compound ALK, ALKBH3, NNMT MAPT 3262/4885KDM4E 244/4885HPGD 2782/4885
US-20250188073-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS KRAS, NRAS, HRAS MAPT 4509/4885KDM4E 4221/4885HPGD 799/4885
US-12410180-B2 Light-emitting device, light-emitting apparatus, electronic device, and lighting device SLC18A3, SLC1A2, SLC18A1 MAPT 1843/4885KDM4E 3219/4885HPGD 2397/4885
US-20260096277-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING SAME CYP1A1, CYP1B1, CHRM1 MAPT 3191/4885KDM4E 3459/4885HPGD 2434/4885
US-20020173652-A1 Process for preparing a polyaromatic compound PAH, ALK, ITPA MAPT 3747/4885KDM4E 2223/4885HPGD 1886/4885

“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.