SCHEMBL486689

SCHEMBL486689

CCc1ccccc1N1CCC(=O)CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.50
MGLL Q99685 1/20 0.48
HTR1A P08908 3/20 0.47
DRD2 P14416 3/20 0.47
DRD4 P21917 3/20 0.47
HTR2A P28223 3/20 0.47
HTR2C P28335 3/20 0.47
DRD3 P35462 3/20 0.47
TSHR P16473 2/20 0.47
LMNA P02545 4/20 0.45
GAA P10253 1/20 0.44
GFER P55789 1/20 0.44
USP2 O75604 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
CASP1 P29466 1/20 0.43

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
Hydrochloric Acid SCHEMBL486707 0.98 ALOX5 (0.49) ALOX5MGLLHTR1ADRD2DRD4
SCHEMBL10424519 0.86 HTR1A (0.59) ALOX5MGLLHTR1ADRD2DRD4
SCHEMBL8776692 0.82 NCF1 (0.54) ALOX5MGLLHTR1ADRD2DRD4
SCHEMBL6514775 0.80 KEAP1 (0.53) ALOX5MGLLHTR1ADRD2DRD4
Hydrochloric Acid SCHEMBL29156848 0.78 KEAP1 (0.52) ALOX5MGLLHTR1ADRD2DRD4
SCHEMBL1361268 0.78 ADRB1 (0.58) ALOX5MGLLTSHRLMNAALDH1A1
SCHEMBL20133784 0.78 HTR1A (0.53) ALOX5MGLLHTR1ADRD2DRD4
Nitrogen SCHEMBL4600854 0.78 NCF1 (0.51) ALOX5MGLLHTR1ADRD2DRD4
Hydrochloric Acid SCHEMBL28740234 0.78 NCF1 (0.56) ALOX5MGLLHTR1ADRD2DRD4
Methylamine SCHEMBL6478870 0.78 NCF1 (0.56) ALOX5MGLLHTR1ADRD2DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117551203-A Preparation process of fentanyl monoclonal antibody 浙江工商大学 2024-02-13 CN claimed
CN-111257574-B Fluorescent immunity rapid detection card for rapid screening of fentanyl substances and preparation method 中检国研(北京)科技有限公司 2024-01-16 CN claimed
CN-111257574-A Fluorescence immunoassay rapid detection card for rapidly screening fentanyl substances and preparation method thereof 中检国研(北京)科技有限公司 2020-06-09 CN claimed
US-20060100438-A1 Process of making fentanyl intermediates BOEHRINGER INGELHEIM CHEMICALS, INC. (US) 2006-05-11 US claimed
CN-117551203-A Preparation process of fentanyl monoclonal antibody 浙江工商大学 2024-02-13 CN disclosed
CN-111257574-B Fluorescent immunity rapid detection card for rapid screening of fentanyl substances and preparation method 中检国研(北京)科技有限公司 2024-01-16 CN disclosed
CN-106795117-B Heterobicyclic compounds and their use for the treatment of tuberculosis 大塚制药株式会社 2020-06-26 CN disclosed
CN-111257574-A Fluorescence immunoassay rapid detection card for rapidly screening fentanyl substances and preparation method thereof 中检国研(北京)科技有限公司 2020-06-09 CN disclosed
US-10464926-B2 Heterobicyclic compounds and their use for the treatment of tuberculosis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2019-11-05 US disclosed
EP-3186240-B1 HETEROBICYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMA CO LTD (JP) 2019-06-12 EP disclosed
US-20180312488-A1 HETEROBICYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2018-11-01 US disclosed
US-10053446-B2 Heterobicyclic compounds and their use for the treatment of tuberculosis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2018-08-21 US disclosed
US-4414219-A ANTICONVULSANTS, TRANQUILIZERS, ANALGESTICS AMERICAN HOECHST CORPORATION (US) 1983-11-08 US disclosed
US-4410536-A 7,8,9,10-Tetrahydrothieno[3,2-e]pyrido[4,3-b]indole compounds and their anti-depressant use TROPONWERKE GMBH & CO. K.G. (DE) 1983-10-18 US disclosed
EP-0012347-B1 7,8,9,10-TETRAHYDROTHIENO(3,2-E)PYRIDO(4,3-B)INDOLES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM Troponwerke GmbH & Co. KG (DE) 1982-07-28 EP disclosed
US-4311703-A PYRROLIDINE AND PIPERIDINE DERIVATIVES AMERICAN HOECHST CORPORATION (US) 1982-01-19 US disclosed
US-4241071-A Antidepressant (α-phenyl-2-tolyl)azacycloalkanes AMERICAN HOECHST CORPORATION (US) 1980-12-23 US disclosed
EP-0012347-A1 7,8,9,10-Tetrahydrothieno(3,2-e)pyrido(4,3-b)indoles, process for their preparation and medicaments containing them Troponwerke GmbH & Co. KG (DE) 1980-06-25 EP disclosed
US-3985889-A 1,3-DIHYDROSPIRO(ISOBENZOFURAN); ANALGETIC AGENTS AMERICAN HOECHST CORPORATION (US) 1976-10-12 US disclosed
US-3962259-A TRANQUILIZERS, ANALGETIC AGENTS AMERICAN HOECHST CORPORATION (US) 1976-06-08 US 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 (4 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-10053446-B2 Heterobicyclic compounds and their use for the treatment of tuberculosis FNTB, SLC11A2, TBCD ALOX5 3724/4885MGLL 2732/4885HTR1A 4686/4885
US-10464926-B2 Heterobicyclic compounds and their use for the treatment of tuberculosis FNTB, SLC11A2, TBCD ALOX5 3724/4885MGLL 2732/4885HTR1A 4686/4885
US-20180312488-A1 HETEROBICYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF TUBERCULOSIS FNTB, SLC11A2, TBCD ALOX5 3724/4885MGLL 2732/4885HTR1A 4686/4885
US-20060100438-A1 Process of making fentanyl intermediates OPRK1, OPRD1, OPRM1 ALOX5 931/4885MGLL 3923/4885HTR1A 133/4885

“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.