Fluorobenzene

Fluorobenzene

SCHEMBL20558451

Fc1ccccc1.N=C=O

nearest known ligand 0.40

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.40
KCNN4 O15554 3/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
PKM P14618 1/20 0.34
HPGD P15428 3/20 0.33
LMNA P02545 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ALPG P10696 1/20 0.33
KMT2A Q03164 2/20 0.32
PTGS1 P23219 1/20 0.32
MEN1 O00255 1/20 0.32
BCL2L1 Q07817 1/20 0.32
BAD Q92934 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32

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
Fluorobenzene SCHEMBL9630082 1.00 NFE2L2 (0.40) NFE2L2KCNN4NPC1RAB9APKM
Fluorobenzene SCHEMBL11680297 0.95 NFE2L2 (0.37) NFE2L2KCNN4NPC1RAB9APKM
Fluorobenzene SCHEMBL28813818 0.88 NFE2L2 (0.43) NFE2L2KCNN4NPC1RAB9APKM
SCHEMBL27644939 0.84 CES2 (0.43) KCNN4NPC1RAB9AALDH1A1BCL2L1
Fluorobenzene SCHEMBL6162846 0.82 NFE2L2 (0.40) NFE2L2KCNN4NPC1RAB9AHPGD
Fluorobenzene SCHEMBL7024891 0.80
SCHEMBL22526495 0.80 NFE2L2 (0.53) NFE2L2KCNN4NPC1RAB9AALDH1A1
Fluorobenzene SCHEMBL14012524 0.80
Fluorobenzene SCHEMBL12363 0.80
Fluorobenzene SCHEMBL15544432 0.80 NFE2L2 (0.53) NFE2L2KCNN4NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117525585-A Low-temperature electrolyte of lithium ion battery and lithium ion battery 合肥乾锐科技有限公司 2024-02-06 CN claimed
CN-107488146-B Isocorydine derivative and preparation method and application thereof 中国科学院兰州化学物理研究所 2020-05-22 CN claimed
EP-3403651-B1 ISOCORYDINE DERIVATIVES, PREPARATION METHOD AND USE THEREOF LANZHOU INST CHEMICAL PHYSICS CAS (CN) 2019-10-30 EP claimed
US-20180334448-A1 Isocorydine derivatives, preparation method and use thereof LANZHOU INSTITUTE OF CHEMICAL PHYSICS, CHINESE ACADEMY OF SCIENCES (CN) 2018-11-22 US claimed
EP-3403651-A1 ISOCORYDINE DERIVATIVES, PREPARATION METHOD AND USE THEREOF Lanzhou Institute Of Chemical Physics Chinese Academy of Sciences (CN) 2018-11-21 EP claimed
CN-107488146-A ICD derivative and its preparation method and application 中国科学院兰州化学物理研究所 2017-12-19 CN claimed
CN-114380874-B Macrolide antibiotics, preparation method and application thereof 中国医学科学院医药生物技术研究所 2024-06-21 CN disclosed
CN-118221633-A TRPV1/URAT1 dual inhibitor, preparation method and application thereof 郑州大学第一附属医院 2024-06-21 CN disclosed
CN-116082195-B Pleuromutilin urea compounds, and preparation method and application thereof 中国医学科学院药物研究所 2024-03-26 CN disclosed
CN-117525585-A Low-temperature electrolyte of lithium ion battery and lithium ion battery 合肥乾锐科技有限公司 2024-02-06 CN disclosed
CN-117525585-A Low-temperature electrolyte of lithium ion battery and lithium ion battery 合肥乾锐科技有限公司 2024-02-06 CN disclosed
WO-2023236263-A1 BENZOXAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 苏州大学 2023-12-14 WO disclosed
CN-116082195-A Pleuromutilin urea compounds, and preparation method and application thereof 中国医学科学院药物研究所 2023-05-09 CN disclosed
CN-1205468-C Method and reagents for quantification of solid-phase reactions using fluorine NMR AVENTISS PHARMACEUTICAL PRODUC (US) 2005-06-08 CN disclosed
CN-1478078-A Nitrogen-containing aromatic ring derivatives ������������ʽ���� 2004-02-25 CN disclosed
CN-1284165-A Method and reagents for quantification of solid-phase reactions using fluorine NMR AVENTISS PHARMACEUTICAL PRODUC (US) 2001-02-14 CN disclosed
CN-1027640-C Process for producing novel trifluoromethyl ketone substituted peptide derivatives ICI AMERICA INC (US) 1995-02-15 CN disclosed
CN-87100707-A Nitrogenous condensed heterocyclic compouds, its preparation method and contain their formula of medicine 1987-09-02 CN disclosed
CN-86105597-A Make the method for novel pyrazoline compounds 1987-02-25 CN disclosed
CN-86101066-A Process for producing novel trifluoromethyl ketone substituted peptide derivatives 1986-11-05 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180334448-A1 Isocorydine derivatives, preparation method and use thereof CCND2, CCND3, IDH3A NFE2L2 928/4885KCNN4 560/4885NPC1 910/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.