SCHEMBL28448358

SCHEMBL28448358

CCCOc1ccc(F)cc1I

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.48
HTR2B P41595 2/20 0.48
HTR2A P28223 1/20 0.48
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
CASP1 P29466 1/20 0.43
HTT P42858 1/20 0.43
CASP7 P55210 1/20 0.43
KMT2A Q03164 1/20 0.43
ATM Q13315 1/20 0.43
CSNK2A1 P68400 2/20 0.40
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39

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
SCHEMBL29066374 0.91 CYP1A2 (0.44) HTR2CHTR2BHTR2AKDM4EMEN1
SCHEMBL15065521 0.88 CYP1A2 (0.39) HTR2CHTR2BHTR2AL3MBTL1CYP1A2
SCHEMBL20516081 0.86 F2 (0.44) HTR2CHTR2BHTR2AMAPTALDH1A1
SCHEMBL725628 0.86 F2 (0.41) HTR2CHTR2BHTR2ATHRATHRB
SCHEMBL22138659 0.85 L3MBTL1 (0.44) MAPTKDM4EMEN1ALDH1A1POLB
SCHEMBL29469907 0.85 L3MBTL1 (0.44) MAPTKDM4EMEN1ALDH1A1POLB
SCHEMBL19382957 0.84 F2 (0.37) HTR2CHTR2BHTR2ATHRATHRB
SCHEMBL19373833 0.82 L3MBTL1 (0.42) MAPTKDM4EMEN1USP2ALDH1A1
SCHEMBL17861666 0.81 PKM (0.37) HTR2CHTR2BHTR2A
SCHEMBL5961831 0.81 HTR2C (0.50) HTR2CHTR2BHTR2AMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115298227-B Group III and lanthanide bis-phenyl-phenoxy metal-ligand complexes 陶氏环球技术有限责任公司 2024-06-04 CN disclosed
CN-111491942-B Metal-ligand complex, catalyst composition, and method for producing same 沙特基础工业爱思开NEXLENE私人有限公司 2024-01-12 CN disclosed
CN-117069749-A Group III and lanthanide bis-phenyl-phenoxy metal-ligand complexes 陶氏环球技术有限责任公司 2023-11-17 CN disclosed
CN-115298227-A Group III and lanthanide bis-phenyl-phenoxy metal-ligand complexes 陶氏环球技术有限责任公司 2022-11-04 CN disclosed
CN-113201084-A Molecular weight control of polyolefins using halogenated bisphenylphenoxy catalysts 陶氏环球技术有限责任公司 2021-08-03 CN disclosed
CN-107041138-B Pentacomplex bisphenylphenoxy catalyst for preparing vinyl polymer 陶氏环球技术有限责任公司 2020-11-27 CN disclosed
CN-111491942-A Metal-ligand complex, catalyst composition for ethylene polymerization comprising same, and method for producing ethylene polymer using same 沙特基础工业爱思开NEXLENE私人有限公司 2020-08-04 CN disclosed