SCHEMBL3920564

SCHEMBL3920564

Fc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.48
HTR3E A5X5Y0 1/20 0.48
HTR3B O95264 1/20 0.48
HTR3A P46098 1/20 0.48
HTR3D Q70Z44 1/20 0.48
HTR3C Q8WXA8 1/20 0.48
KDR P35968 1/20 0.48
NOTUM Q6P988 6/20 0.46
HSD11B1 P28845 2/20 0.43
RAPGEF4 Q8WZA2 1/20 0.43
PDK1 Q15118 1/20 0.43
OPRL1 P41146 1/20 0.43
NPFFR2 Q9Y5X5 3/20 0.42
NPFFR1 Q9GZQ6 2/20 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
SCHEMBL29572246 1.00 IDO1 (0.48) IDO1HTR3EHTR3BHTR3AHTR3D
Carbamic Acid SCHEMBL11788382 0.87 HTR3E (0.51) IDO1HTR3EHTR3BHTR3AHTR3D
SCHEMBL364144 0.81 HSD11B1 (0.44) IDO1NOTUMHSD11B1
SCHEMBL18167293 0.81 TSHR (0.43) IDO1HTR3EHTR3BHTR3AHTR3D
SCHEMBL29435960 0.81 HSD11B1 (0.44) IDO1NOTUMHSD11B1
SCHEMBL803635 0.79 PTGS1 (0.39) IDO1HSD11B1
SCHEMBL29649700 0.78 IDO1 (0.50) IDO1HTR3EHTR3BHTR3AHTR3D
SCHEMBL2698021 0.78 NOTUM (0.61) IDO1HTR3EHTR3BHTR3AHTR3D
SCHEMBL987352 0.78 IDO1 (0.50) IDO1HTR3EHTR3BHTR3AHTR3D
SCHEMBL7601736 0.77 IDO1 (0.50) IDO1NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113277942-B Method for rapidly preparing 5-chloro-2-fluoro-4- (trifluoromethyl) benzoic acid based on microchannel reaction technology 都创(上海)医药开发有限公司 2024-05-03 CN claimed
CN-113277942-A Method for rapidly preparing 5-chloro-2-fluoro-4- (trifluoromethyl) benzoic acid based on microchannel reaction technology 都创(上海)医药开发有限公司 2021-08-20 CN claimed
CN-112058115-A Stirring and filtering integrated device for preparing 2-chloro-5-fluorobenzotrifluoride 上海思阔化学科技有限公司 2020-12-11 CN claimed
US-4603222-A Method for the preparation of nitrodiphenyl ethers OCCIDENTAL CHEMICAL CORPORATION (US) 1986-07-29 US claimed
EP-0173349-A1 Method for the preparation of nitrodiphenyl ethers OCCIDENTAL CHEMICAL CORPORATION (US) 1986-03-05 EP claimed
EP-0159388-A2 Preparation of nuclear chlorinated compounds OCCIDENTAL CHEMICAL CORPORATION (US) 1985-10-30 EP claimed
US-4470930-A Preparation of nuclear chlorinated aromatic compounds OCCIDENTAL CHEMICAL CORPORATION (US) 1984-09-11 US claimed
US-4469893-A Method for the preparation of nitrodiphenyl ethers OCCIDENTAL CHEMICAL CORPORATION (US) 1984-09-04 US claimed
US-4424396-A ARYL HALIDE, A-AMINOACID OCCIDENTAL CHEMICAL CORPORATION (US) 1984-01-03 US claimed
JP-62289534-A None JP disclosed
EP-4583867-A2 SODIUM CHANNEL BLOCKING COMPOUNDS, DERIVATIVES THEREOF, AND METHODS OF THEIR USE Latigo Biotherapeutics, Inc. (US) 2025-07-16 EP disclosed
WO-2024217344-A1 NAV1.8 INHIBITORS, PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院上海药物研究所 2024-10-24 WO disclosed
CN-118324743-A Nav1.8 inhibitor and preparation method and application thereof 中国科学院上海药物研究所 2024-07-12 CN disclosed
CN-114437062-B Compound capable of being used as sodium channel regulator and application thereof 成都海博为药业有限公司 2024-05-17 CN disclosed
EP-0159388-A2 Preparation of nuclear chlorinated compounds OCCIDENTAL CHEMICAL CORPORATION (US) 1985-10-30 EP disclosed
EP-0125803-A2 Pharmaceutically active dihydropyridines FISONS plc (GB) 1984-11-21 EP disclosed
US-4470930-A Preparation of nuclear chlorinated aromatic compounds OCCIDENTAL CHEMICAL CORPORATION (US) 1984-09-11 US disclosed
US-4469893-A Method for the preparation of nitrodiphenyl ethers OCCIDENTAL CHEMICAL CORPORATION (US) 1984-09-04 US disclosed
US-4424396-A ARYL HALIDE, A-AMINOACID OCCIDENTAL CHEMICAL CORPORATION (US) 1984-01-03 US disclosed
EP-0095117-A1 Phenoxypropionic-acid derivatives, processes for their preparation and their use as herbicides BAYER AG (DE) 1983-11-30 EP disclosed