Iodobenzene

Iodobenzene

SCHEMBL2237441

Ic1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CES1 P23141 6/20 0.50
TPMT P51580 1/20 0.42
CPA1 P15085 1/20 0.40
CYP1A2 P05177 1/20 0.39
TRPV1 Q8NER1 2/20 0.39
PTPN1 P18031 1/20 0.38
FAAH O00519 3/20 0.37
HDAC6 Q9UBN7 2/20 0.37

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
Iodobenzene SCHEMBL2485086 1.00 CES1 (0.50) CES1TPMTCPA1CYP1A2TRPV1
Iodobenzene SCHEMBL334303 1.00 CES1 (0.50) CES1TPMTCPA1CYP1A2TRPV1
Iodobenzene SCHEMBL15140156 0.93 CES1 (0.45) CES1TPMTCPA1CYP1A2TRPV1
Iodobenzene SCHEMBL27524285 0.88 CES1 (0.54) CES1TPMTCPA1TRPV1PTPN1
Iodobenzene SCHEMBL28043258 0.88 CES1 (0.41) CES1TPMTCPA1TRPV1FAAH
Iodobenzene SCHEMBL28291735 0.88 CES1 (0.41) CES1TPMTCPA1CYP1A2TRPV1
Trifluoroacetic Acid SCHEMBL28511407 0.81 TPMT (0.44) CES1TPMTTRPV1
Pivalate SCHEMBL28120842 0.80 TPMT (0.42) TPMTCYP1A2HDAC6
Pivalate SCHEMBL5330607 0.80 TPMT (0.42) TPMTCYP1A2HDAC6
Trifluoroacetic Acid SCHEMBL8845061 0.79 TPMT (0.43) CES1TPMTTRPV1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119638697-A ERVITSINE total synthesis method 南方科技大学 2025-03-18 CN claimed
CN-116425760-B Synthesis method of chiral (-) -cephalotaxine, intermediate and analogue thereof 兰州大学 2024-11-26 CN claimed
CN-118344425-A Polyhydroxy pentacyclic triterpene compound and preparation method and application thereof 华东理工大学 2024-07-16 CN claimed
CN-117777047-B N-substituted azaspiro-decone compounds, preparation method and application thereof 四川大学 2024-04-30 CN claimed
CN-109608461-B Method for synthesizing pyridine [1',2':1,5] pyrazole [3,4-b ] quinoxaline compound 河南师范大学 2024-04-16 CN claimed
CN-117777047-A N-substituted azaspiro-decone compounds, preparation method and application thereof 四川大学 2024-03-29 CN claimed
CN-115197085-B Preparation method of 2-amino-5-chloro-N, 3-dimethylbenzamide 九江善水科技股份有限公司 2024-02-13 CN claimed
CN-114057760-B Indoloquinazolinone spiro 1, 3-dioxolane compound, preparation method and application thereof 成都大学 2023-10-20 CN claimed
CN-112521395-B Preparation method of galanthamine 鲁南制药集团股份有限公司 2023-09-05 CN claimed
CN-112521364-B Galanthamine intermediate compound V 鲁南制药集团股份有限公司 2023-09-05 CN claimed
CN-103588720-A Synthesis method of benzo [c] isoxazole-3(1H)-ketone UNIV HEBEI SCIENCE & TECH 2014-02-19 CN claimed
CN-103373969-A Phenyl imidazole ring-substituted amide compounds as well as preparation method and application for same SHANGHAI INST ORGANIC CHEM 2013-10-30 CN claimed
CN-103214407-A Method for preparing pyrrolidine derivative UNIV BEIJING 2013-07-24 CN claimed
CN-103172637-A Pyrimido [1, 2-a] benzimidazole compound and method for preparing same UNIV SHANGHAI 2013-06-26 CN claimed
CN-103012422-A Preparation and application of 5,11-methylenemorphanthridine compound UNIV LANGZHOU 2013-04-03 CN claimed
CN-101454286-B Process for producing phenoxypyridine derivative EISAI R&D MAN CO LTD 2011-07-20 CN claimed
CN-101665492-A 1,6,7, 12-tetraphenyl perylene bisimide derivatives and preparation method thereof UNIV DALIAN TECH 2010-03-10 CN claimed
CN-101454286-A Process for producing phenoxypyridine derivative EISAI R&D MAN CO LTD (JP) 2009-06-10 CN claimed
CN-1633445-A Process for preparing eplerenone PHARMACIA CORP (US) 2005-06-29 CN claimed
US-5463072-A Process for the preparation of naphtholic 2-equivalent cyan couplers AGFA GEVART AG, D-51368 (DE) 1995-10-31 US claimed