SCHEMBL415546

SCHEMBL415546

FC(F)(F)c1ccc(S)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
TSHR P16473 1/20 0.50
KIF11 P52732 6/20 0.48
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
ORAI1 Q96D31 1/20 0.46
ORAI2 Q96SN7 1/20 0.46
ORAI3 Q9BRQ5 1/20 0.46
TRPV6 Q9H1D0 1/20 0.46
MGLL Q99685 1/20 0.46
TRPV4 Q9HBA0 1/20 0.44
TAAR1 Q96RJ0 1/20 0.42
EPHX2 P34913 1/20 0.41
HTR3E A5X5Y0 1/20 0.41
HTR3B O95264 1/20 0.41
PLAU P00749 1/20 0.41
HTR3A P46098 1/20 0.41
HTR3D Q70Z44 1/20 0.41
HTR3C Q8WXA8 1/20 0.41
IDO1 P14902 1/20 0.41

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
Fluoride SCHEMBL29094699 0.97 ALDH1A1 (0.48) ALDH1A1TSHRKIF11CES2CES1
SCHEMBL1765830 0.92 KIF11 (0.61) ALDH1A1TSHRKIF11
SCHEMBL7672068 0.85 LTA4H (0.45) ALDH1A1TSHRKIF11
Alcohol SCHEMBL2201593 0.85 KIF11 (0.41) ALDH1A1TSHRKIF11CES2CES1
SCHEMBL8765728 0.83 PDE2A (0.52) ALDH1A1TSHRKIF11CES2CES1
SCHEMBL63468 0.83 ALDH1A1 (0.67) ALDH1A1TSHRKIF11CES2CES1
SCHEMBL7594733 0.82 SRD5A2 (0.68) TSHRCES2CES1EPHX2
Trifluoromethylbenzene SCHEMBL27551699 0.80 TSHR (0.74) ALDH1A1TSHRKIF11TRPV6IDO1
SCHEMBL11154793 0.79 TRPV4 (0.37) TRPV4IDO1
SCHEMBL2092992 0.77 TRPV4 (0.36) TRPV4IDO1

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 1258 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118515519-B Preparation method of organic thioether compound NANJING TECH UNIVERSITY (CN) 2026-05-26 CN claimed
EP-4646271-A1 SUBSTITUTED SPIROCYCLIC-PYRROLOQUINAZOLINONES AND SPIROCYCLIC-PIPERIDINOQUINAZOLINONES Mirati Therapeutics, Inc. (US) 2025-11-12 EP claimed
CN-119977855-A Thiohydrazone method for synthesizing compound 山东金科力电源科技有限公司 2025-05-13 CN claimed
CN-118978827-A AgBiS2Nanocrystalline ink, preparation method and application thereof in photoelectric device 苏州大学 2024-11-19 CN claimed
CN-118515519-A Preparation method of organic thioether compound 南京工业大学 2024-08-20 CN claimed
CN-118479989-A Perfluoro alkenyl aryl thioether and preparation method thereof 广东电网有限责任公司 2024-08-13 CN claimed
CN-113278153-B Polymer, process for producing the same and process for depolymerizing the same 北京大学 2024-07-12 CN claimed
WO-2024148150-A1 SUBSTITUTED SPIROCYCLIC-PYRROLOQUINAZOLINONES AND SPIROCYCLIC-PIPERIDINOQUINAZOLINONES Mirati Therapeutics, Inc. (US) 2024-07-11 WO claimed
CN-118042860-A Composite material, preparation method thereof, light-emitting device and display device TCL科技集团股份有限公司 2024-05-14 CN claimed
CN-117624491-A Self-repairing dual-curing photosensitive resin material and preparation method thereof 福建理工大学 2024-03-01 CN claimed
CN-102285927-A Method for preparing ponazuril serving as anticoccidiosis medicament QINGDAO KDN PHARMACEUTICAL CO 2011-12-21 CN claimed
EP-1598349-B1 NOVEL 2-PYRIDINECARBOXAMIDE DERIVATIVES MSD KK (JP) 2011-07-27 EP claimed
WO-2005047238-A2 METHOD FOR SYNTHESISING DIARYL ALCOHOL SULPHIDE COMPOUNDS IN A SOLID PHASE GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-05-26 WO claimed
WO-2005047237-A1 METHOD FOR SYNTHESISING DIARYL SULPHIDE COMPOUNDS IN A SOLID PHASE GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-05-26 WO claimed
US-4659720-A POULTRY ANTIPROTOZOA AGENT MERCK & CO., INC. (US) 1987-04-21 US claimed
EP-0113570-B1 5-(AMINO OR SUBSTITUTED AMINO) IMIDAZOLES MERCK & CO. INC. (US) 1987-02-25 EP claimed
US-4622330-A Antiprotozoal 3-amino or substituted amino pyrazoles MERCK & CO., INC. (US) 1986-11-11 US claimed
US-4588844-A Process for preparing aromatic aldehydes BAYER AKTIENGESELLSCHAFT (DE) 1986-05-13 US claimed
EP-0113570-A1 5-(Amino or substituted amino) imidazoles MERCK & CO. INC. (US) 1984-07-18 EP claimed
US-4366309-A MACROLACTONES SCHERING CORPORATION (US) 1982-12-28 US claimed