SCHEMBL990583

SCHEMBL990583

[Li]c1ccccc1F

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Boric Acid SCHEMBL28194648 0.89 CES2 (0.37)
Boric Acid SCHEMBL27491138 0.89 CES2 (0.37)
Sulfuric Acid SCHEMBL28019611 0.84 CES2 (0.39)
SCHEMBL1670337 0.75
SCHEMBL29352330 0.73
SCHEMBL45406 0.73
SCHEMBL3891682 0.73
SCHEMBL29905653 0.73
SCHEMBL30125159 0.72 PDK2 (0.39)
Bromide SCHEMBL1357794 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102485726-B Method for preparing 1-R-1'-spiro-(piperidine-4,4'-quinoline)-2'(3'-hydrogen) ketone WUXI APPTEC CO LTD 2015-07-01 CN claimed
CN-102485726-A Method for preparing 1-R-1'-spiro-(piperidine-4,4'-quinoline)-2'(3'-hydrogen)ketone WUXI APPTEC CO LTD 2012-06-06 CN claimed
JP-10081643-A None JP disclosed
US-20250154193-A1 STEROID COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Cholesgen (Shanghai) Co., Ltd. (CN) 2025-05-15 US disclosed
CN-116789726-A Steroid compound, preparation method and application thereof 珂阑(上海)医药科技有限公司 2023-09-22 CN disclosed
WO-2023143399-A1 STEROID COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 珂阑(上海)医药科技有限公司 2023-08-03 WO disclosed
WO-2023143398-A1 STEROID AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 珂阑(上海)医药科技有限公司 2023-08-03 WO disclosed
CN-116514893-A Steroid compound, preparation method and application thereof 珂阑(上海)医药科技有限公司 2023-08-01 CN disclosed
CN-106574008-A Polycyclo-olefinic block polymers and pervaporation membranes made therefrom 普罗米鲁斯有限责任公司 2017-04-19 CN disclosed
US-9139594-B2 Fused aminodihydropyrimidone derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-09-22 US disclosed
EP-2233474-B1 CONDENSED AMINODIHYDROTHIAZINE DERIVATIVE EISAI R&D MAN CO LTD (JP) 2015-08-05 EP disclosed
EP-0440082-B1 Method for the conversion of fluorinated aromatic compounds using electrophiles MERCK PATENT GMBH (DE) 1998-04-15 EP disclosed
JP-H1081643-A PRODUCTION OF ARYLKETONES TAKEDA CHEM IND LTD 1998-03-31 JP disclosed
EP-0661259-B1 Substituted (5,6)-dihydronaphthalenyl compounds having retinoid-like activity BRISTOL MYERS SQUIBB CO (US) 1997-10-08 EP disclosed
CN-1144217-A Retinoid-like compounds BRISTOL MYERS SQUIBB CO (US) 1997-03-05 CN disclosed
EP-0661259-A1 Substituted (5,6)-dihydronaphthalenyl compounds having retinoid-like activity BRISTOL-MYERS SQUIBB COMPANY (US) 1995-07-05 EP disclosed
EP-0601156-A1 CROSS-COUPLING PROCESS OF BORIC ACIDS WITH HALOGENATED COMPOUNDS MERCK PATENT GmbH (DE) 1994-06-15 EP disclosed
WO-1994000423-A1 CROSS-COUPLING PROCESS OF BORIC ACIDS WITH HALOGENATED COMPOUNDS MERCK PATENT GMBH (DE) 1994-01-06 WO disclosed
US-5262556-A Alkylation or hydroxyalkylation by deprotonation MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-11-16 US disclosed
EP-0440082-A2 Method for the conversion of fluorinated aromatic compounds using electrophiles MERCK PATENT GmbH (DE) 1991-08-07 EP disclosed