SCHEMBL66819

SCHEMBL66819

O=Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.46
RPS6KA3 P51812 1/20 0.43
JAK3 P52333 1/20 0.43
KIF11 P52732 1/20 0.38
IDO1 P14902 3/20 0.37
TDO2 P48775 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
FBP1 P09467 1/20 0.36
CYP1A2 P05177 1/20 0.34

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
SCHEMBL6856533 0.95 CES2 (0.41) CES2RPS6KA3JAK3KIF11ALDH1A1
SCHEMBL18002229 0.91 AHR (0.41) CES2RPS6KA3JAK3KIF11FBP1
SCHEMBL30070463 0.86 KIF11 (0.38) CES2RPS6KA3JAK3KIF11ALDH1A1
SCHEMBL478113 0.86 KIF11 (0.38) CES2RPS6KA3JAK3KIF11ALDH1A1
SCHEMBL15456420 0.85 CES2 (0.41) CES2RPS6KA3JAK3MAPT
SCHEMBL18002364 0.85 DAO (0.44) CES2RPS6KA3JAK3IDO1TDO2
SCHEMBL344606 0.84 NOTUM (0.43) CES2RPS6KA3JAK3KIF11IDO1
SCHEMBL29769014 0.84 AHR (0.48) CES2RPS6KA3JAK3KIF11ALDH1A1
SCHEMBL13616882 0.84 PTGS1 (0.48) CES2RPS6KA3JAK3IDO1ALDH1A1
SCHEMBL2474610 0.84 NFE2L2 (0.41) CES2RPS6KA3JAK3KIF11MAPT

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 1210 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122011612-A Chlorosulfonated polyethylene rubber with high heat resistance and preparation method thereof 江西华琪合成橡胶有限公司 2026-05-12 CN claimed
CN-120118070-A Molecular chaperone HSP 70-mediated EML4-ALK targeted degradation agent, preparation method and application 浙江大学 2025-06-10 CN claimed
CN-117143598-B High-entropy carbon quantum dot nanomaterial and preparation method and application thereof 中南大学 2024-11-08 CN claimed
CN-118580159-A Synthesis method of nitrogen heterocyclic aromatic hydrocarbon modified beta-amino acid ester 国科大杭州高等研究院 2024-09-03 CN claimed
CN-118459422-A Thiazole thiazolinone compound containing multiple halogen atoms and preparation method thereof 南京工业大学 2024-08-09 CN claimed
CN-118459420-A Thiazolinone compound containing multiple halogen atoms and preparation method thereof 南京工业大学 2024-08-09 CN claimed
CN-117229707-A High-strength wear-resistant aluminum veneer and preparation method thereof 兴恒泰有限公司 2023-12-15 CN claimed
CN-117143598-A High-entropy carbon quantum dot nanomaterial and preparation method and application thereof 中南大学 2023-12-01 CN claimed
CN-116396475-A Nano-carrier based on fluorinated polymer and preparation method and application thereof 浙江大学 2023-07-07 CN claimed
US-20230215723-A1 METHODS OF MANUFACTURING INTEGRATED CIRCUIT DEVICES USING CARBONYL COMPOUNDS ADEKA CORPORATION (JP) 2023-07-06 US claimed
US-6150378-A 1-((1-HALO-SUBSTITUTEDBENZOYLAMINO)-2-PHENYLETHYL)-CARBONYL -CARBONYLAMINO),2-PHENYL OR PYRID-2-YLSULFAMIDO)ETHANE DERIVATIVES; MUSCULAR DYSTROPHY, NEURODEGENERATION, STROKE, ALZHEIMER'S, AMYOTROPHY, MOTOR NEURON DAMAGE, CNS INJURY CEPHALON, INC. (US) 2000-11-21 US claimed
WO-2000012074-A2 USE OF PIPERIDINES AND/OR PIPERAZINES AS INHIBITORS OF P38-ALPHA KINASE SCIOS INC. (US) 2000-03-09 WO claimed
EP-0983507-A1 TRICYCLIC TETRAHYDROQUINOLINE DERIVATIVES AND TRICYCLIC TETRAHYDROQUINOLINE COMBINATORIAL LIBRARIES Trega Biosciences, Inc. (US) 2000-03-08 EP claimed
EP-0977989-A1 4-SUBSTITUTED-QUINOLINE DERIVATIVES AND 4-SUBSTITUTE-QUINOLINE COMBINATORIAL LIBRARIES TREGA BIOSCIENCES, INC. (US) 2000-02-09 EP claimed
US-5935951-A ANTAGONIST AGAINST SUBSTANCE P NOVARTIS FINANCE CORPORATION (US) 1999-08-10 US claimed
WO-1998034115-A1 4-SUBSTITUTED-QUINOLINE DERIVATIVES AND 4-SUBSTITUTE-QUINOLINE COMBINATORIAL LIBRARIES TREGA BIOSCIENCES, INC. (US) 1998-08-06 WO claimed
WO-1998034111-A1 TRICYCLIC TETRAHYDROQUINOLINE DERIVATIVES AND TRICYCLIC TETRAHYDROQUINOLINE COMBINATORIAL LIBRARIES TREGA BIOSCIENCES, INC. (US) 1998-08-06 WO claimed
WO-1997045119-A1 USE OF SUBSTANCE P ANTAGONISTS FOR TREATING SOCIAL PHOBIA NOVARTIS AG (CH) 1997-12-04 WO claimed
EP-0783490-A1 1-ACYL-4-ALIPHATYLAMINOPIPERIDINE COMPOUNDS Novartis AG (CH) 1997-07-16 EP claimed
WO-1996010562-A1 1-ACYL-4-ALIPHATYLAMINOPIPERIDINE COMPOUNDS NOVARTIS AG (CH) 1996-04-11 WO claimed