SCHEMBL29607374

SCHEMBL29607374

C[Si](C)(C)c1ccccc1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.40
DRD3 P35462 8/20 0.40
DRD4 P21917 6/20 0.40
DRD1 P21728 3/20 0.40
DRD5 P21918 3/20 0.40
HTR1D P28221 2/20 0.36
HTR5A P47898 1/20 0.36
CHRM1 P11229 1/20 0.34
ELANE P08246 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
SLC22A12 Q96S37 1/20 0.33

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
SCHEMBL1713611 1.00 DRD2 (0.40) DRD2DRD3DRD4DRD1DRD5
SCHEMBL28142221 0.98 DRD2 (0.39) DRD2DRD3DRD4DRD1DRD5
SCHEMBL27745146 0.94 CXCR2 (0.38) DRD2DRD3DRD4DRD1DRD5
SCHEMBL17048114 0.83 EPAS1 (0.37) DRD2DRD3DRD4DRD1DRD5
SCHEMBL17284193 0.83 DRD2 (0.40) DRD2DRD3DRD4DRD1DRD5
SCHEMBL19971751 0.82 PTPN1 (0.39) ADORA2AADORA1
SCHEMBL1712875 0.81 DRD2 (0.43) DRD2DRD3DRD4DRD1DRD5
SCHEMBL30387806 0.81 HSD11B1 (0.38) DRD2DRD3DRD4DRD1DRD5
SCHEMBL14985330 0.81 HSD11B1 (0.38) DRD2DRD3DRD4DRD1DRD5
SCHEMBL30706241 0.81 DRD2 (0.42) DRD2DRD3DRD4DRD1DRD5

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118146238-A Polycyclic spiro indoline compound and preparation method thereof 广西科技大学 2024-06-07 CN claimed
CN-112876503-B Borate compound for cancer boron neutron capture therapeutic medicine and preparation thereof 中国科学院兰州化学物理研究所 2022-04-29 CN claimed
CN-122059864-A Azido-containing seleno-ether compound, seleno-oxide, preparation methods and application 福建师范大学 2026-05-19 CN disclosed
EP-4719605-A1 CHEMICAL COMPOUNDS AND USES THEREOF GlaxoSmithKline Intellectual Property (No.4) Limited (GB) 2026-04-08 EP disclosed
WO-2024246862-A1 CHEMICAL COMPOUNDS AND USES THEREOF GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 4) LIMITED (GB) 2024-12-05 WO disclosed
CN-118146238-A Polycyclic spiro indoline compound and preparation method thereof 广西科技大学 2024-06-07 CN disclosed
EP-4267561-A1 SMALL-MOLECULE MODULATORS OF THE ORPHAN NUCLEAR RECEPTOR TLX Baylor College of Medicine (US) 2023-11-01 EP disclosed
CN-116783183-A 1- (2- (4-cyclopropyl-1H-1, 2, 3-triazol-1-yl) acetyl) -4-hydroxy-N- (benzyl) pyrrolidine-2-carboxamide derivatives as VHL inhibitors for the treatment of anemia and cancer 基因泰克公司 2023-09-19 CN disclosed
CN-116496289-A Synthesis and application of membrane-targeted naphthalene endoperoxides 大连理工大学 2023-07-28 CN disclosed
CN-113105475-B Inhibitors of bruton's tyrosine kinase and methods of use thereof 詹森药业有限公司 2022-09-09 CN disclosed
WO-2022140643-A1 SMALL-MOLECULE MODULATORS OF THE ORPHAN NUCLEAR RECEPTOR TLX BAYLOR COLLEGE OF MEDICINE (US) 2022-06-30 WO disclosed
CN-112876503-B Borate compound for cancer boron neutron capture therapeutic medicine and preparation thereof 中国科学院兰州化学物理研究所 2022-04-29 CN disclosed