SCHEMBL5330355

SCHEMBL5330355

Fc1cc(Cl)ccc1CCl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.42
TP53 P04637 1/20 0.42
HTR1A P08908 1/20 0.42
HTR7 P34969 1/20 0.42
HTR6 P50406 1/20 0.42
IDO1 P14902 2/20 0.41
CXCR3 P49682 4/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
SLC6A4 P31645 5/20 0.40
KCNH2 Q12809 4/20 0.40
SLC6A2 P23975 2/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
CYP3A4 P08684 1/20 0.40
MAPK1 P28482 1/20 0.40
SLC6A3 Q01959 1/20 0.40
GRM2 Q14416 1/20 0.39
ERCC1 P07992 1/20 0.38

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
SCHEMBL10451789 0.83 MEN1 (0.43) HTR2ATP53IDO1HTR2CHTR2B
SCHEMBL4604208 0.83 KMT2A (0.48) HTR2ATP53HTR1AHTR7HTR6
SCHEMBL18482277 0.82 HTR2A (0.41) HTR2ATP53HTR1AHTR7HTR6
SCHEMBL25236513 0.81 HTR2A (0.42) HTR2ATP53HTR1AHTR7HTR6
SCHEMBL4331373 0.79 HTR2A (0.45) HTR2ATP53HTR1AHTR7HTR6
SCHEMBL13908021 0.79 HTR2A (0.41) HTR2ATP53HTR1AHTR7HTR6
SCHEMBL140474 0.79 HTR2A (0.45) HTR2ATP53HTR1AHTR7HTR6
SCHEMBL269324 0.79 HTR2A (0.41) HTR2ATP53HTR1AHTR7HTR6
SCHEMBL134961 0.79 TP53 (0.41) HTR2ATP53HTR1AHTR7HTR6
SCHEMBL17552702 0.79 HTR2A (0.41) HTR2ATP53HTR1AHTR7HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116943570-A 2-fluoro-4-chloro trichlorobenzyl chlorination reaction device 阜新金特莱氟化学有限责任公司 2023-10-27 CN claimed
EP-4673447-A1 [1,3]THIAZOLO[4,5-D]-PYRIMIDIN-7-ONES AS INHIBITORS OF NOX4 Boehringer Ingelheim International GmbH (DE) 2026-01-07 EP disclosed
CN-113493442-B Pyrrolidone derivative as glucokinase activator and preparation method and application thereof 天津药物研究院有限公司 2024-11-08 CN disclosed
US-20240327429-A1 [1,3]Thiazolo[4,5-d]-pyrimidon-7-ones as inhibitors of NOX4 BOEHRINGER INGELHEIM INT (DE) 2024-10-03 US disclosed
WO-2024180018-A1 [1,3]THIAZOLO[4,5-D]-PYRIMIDIN-7-ONES AS INHIBITORS OF NOX4 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-09-06 WO disclosed
CN-116943570-A 2-fluoro-4-chloro trichlorobenzyl chlorination reaction device 阜新金特莱氟化学有限责任公司 2023-10-27 CN disclosed
CN-116943570-A 2-fluoro-4-chloro trichlorobenzyl chlorination reaction device 阜新金特莱氟化学有限责任公司 2023-10-27 CN disclosed
US-20230165846-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. 2023-06-01 US disclosed
US-20230165846-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. 2023-06-01 US disclosed
US-20230165846-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. 2023-06-01 US disclosed
CN-1198742-A Pyrimidin-4-one derivatives, their use as herbicides, intermediates for their production and process for producing these compounds SUMITOMO CHEMICAL CO (JP) 1998-11-11 CN disclosed
EP-0850229-A1 PYRIMIDIN-4-ONE DERIVATIVES, THEIR USE AS HERBICIDES, INTERMEDIATES FOR THEIR PRODUCTION AND PROCESSES FOR PRODUCING THESE COMPOUNDS SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-07-01 EP disclosed
WO-1997006150-A1 PYRIMIDIN-4-ONE DERIVATIVES, THEIR USE AS HERBICIDES, INTERMEDIATES FOR THEIR PRODUCTION AND PROCESSES FOR PRODUCING THESE COMPOUNDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-02-20 WO disclosed
US-4910323-A Chlorination using n-chlorosuccinimide HOECHST ROUSSEL PHARMACEUTICALS, INC. (US) 1990-03-20 US disclosed
US-4847414-A INTERMEDIATES FOR ANTIDEPRESSANTS, ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1989-07-11 US disclosed
EP-0077536-B1 2'-SUBSTITUTED-SPIRO(BENZOFURAN-2(3H),1'-CYCLOALKANES), A PROCESS FOR PREPARING SAME, PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH COMPOUNDS AND THEIR USE AS MEDICAMENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1986-07-16 EP disclosed
US-4594435-A ANTIDEPRESSANTS; ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1986-06-10 US disclosed
US-4517311-A 2'-Substituted-spiro[benzofuran-2(3H),1'-cycloalkanes] and their analgesic and anti-depressant compositions HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-05-14 US disclosed
US-4404221-A ANALGESICS AND ATNIDEPRESSANTS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1983-09-13 US disclosed
EP-0077536-A2 2'-Substituted-spiro(benzofuran-2(3H),1'-cycloalkanes), a process for preparing same, pharmaceutical compositions containing such compounds and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1983-04-27 EP 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 (2 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-20240327429-A1 [1,3]Thiazolo[4,5-d]-pyrimidon-7-ones as inhibitors of NOX4 NOX4, NOX1, NOX5 HTR2A 4151/4885TP53 2824/4885HTR1A 3693/4885
US-20230165846-A1 HETEROCYCLIC GLP-1 AGONISTS GLP1R, GIPR, GCGR HTR2A 169/4885TP53 4121/4885HTR1A 63/4885

“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.