SCHEMBL2708686

SCHEMBL2708686

Fc1ccc(F)c(CCl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 1/20 0.47
PSEN2 P49810 1/20 0.47
APH1B Q8WW43 1/20 0.47
NCSTN Q92542 1/20 0.47
APH1A Q96BI3 1/20 0.47
PSENEN Q9NZ42 1/20 0.47
CA3 P07451 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
CA5B Q9Y2D0 1/20 0.42
DPP4 P27487 2/20 0.42
IDO1 P14902 2/20 0.39
AGXT P21549 2/20 0.39
RIPK1 Q13546 2/20 0.39
MMP2 P08253 2/20 0.38
MMP12 P39900 2/20 0.38
MMP1 P03956 1/20 0.38
MMP9 P14780 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
SCHEMBL28056457 0.82 IDO1 (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL30232393 0.81 PSEN1 (0.44) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10451789 0.80 MEN1 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1503215 0.80 IDO1 (0.54) CA3CA6CA5ACA9CA14
SCHEMBL7700255 0.79 CA3 (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5252643 0.79 MPO (0.49) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2370502 0.78 SLC6A4 (0.40) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL23680016 0.76 PSEN1 (0.33) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20560697 0.76 IDO1 (0.33) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL20560539 0.76 DPP4 (0.40) DPP4MEN1KMT2AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080177077-A1 PROCESSES FOR THE PREPARATION OF 3-(4-(2,4-DIFLUOROBENZYLOXY)-3-BROMO-6-METHYL-2-OXOPYRIDIN-1(2H)-YL)-N,4-DIMETHYLBENZAMIDE PFIZER, INC. 2008-07-24 US claimed
CN-119977950-A Ubiquitin-specific protease 28 small molecule inhibitor and preparation method and application thereof 郑州大学第一附属医院 2025-05-13 CN disclosed
US-20240004296-A1 RESIST UNDERLAYER FILM-FORMING COMPOSITION NISSAN CHEMICAL CORPORATION (JP) 2024-01-04 US disclosed
CN-116419937-A Composition for forming resist underlayer film 日产化学株式会社 2023-07-11 CN disclosed
US-20230149357-A1 THERAPEUTIC AGENT FOR NON-MOTOR SYMPTOMS ASSOCIATED WITH PARKINSON'S DISEASE Sumitomo Pharma Co., Ltd. (JP) 2023-05-18 US disclosed
WO-2023016278-A1 ISOXAZOLE-CONTAINING PYRIDINOPYRIMIDINONE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF 贵州大学 2023-02-16 WO disclosed
CN-113651811-B Isoxazole-containing pyridopyrimidone compound and preparation method and application thereof 贵州大学 2022-06-07 CN disclosed
WO-2022107759-A1 RESIST UNDERLAYER FILM-FORMING COMPOSITION 日産化学株式会社 2022-05-27 WO disclosed
US-11312688-B2 Pyrazole compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2022-04-26 US disclosed
CN-113651811-A Isoxazole-containing pyridopyrimidone compound and preparation method and application thereof 贵州大学 2021-11-16 CN disclosed
US-4536599-A HYDROLYZING THE NITRILE DERIVATIVE TO THE AMIDE USING AN ORGANIC QUATERNARY AMINE SALT CATALYST; EFFICIENCY SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-08-20 US disclosed
US-4521537-A ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1985-06-04 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-4472580-A Spiro (2H-1,4-benzodioxepin-3 (5H)4-piperidine and -3-pyrrolidine) compounds and their use as anti-hypertensive agents HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1984-09-18 US disclosed
EP-0102034-A1 Spiro(2H-1,4-benzodioxepin-3(5H)4'-piperidine and 3'-pyrrolidino) compounds, a process for preparing the same and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1984-03-07 EP disclosed
US-4405631-A Spiro[2H-1,4-benzodioxepin-3(5H)4'-piperidine and -3'pyrrolidine] compounds and their use as antihypertensive agents HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1983-09-20 US disclosed
US-4404221-A ANALGESICS AND ATNIDEPRESSANTS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1983-09-13 US disclosed
EP-0008532-B1 SYNTHESIS OF AMINES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-07-20 EP 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
EP-0008532-A1 Synthesis of amines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-03-05 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 (3 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-11312688-B2 Pyrazole compound HTR2C, HTR3B, HTR3A PSEN1 3275/4885PSEN2 2329/4885APH1B 4058/4885
US-20230149357-A1 THERAPEUTIC AGENT FOR NON-MOTOR SYMPTOMS ASSOCIATED WITH PARKINSON'S DISEASE PARK7, SNCA, ACHE PSEN1 272/4885PSEN2 236/4885APH1B 3527/4885
US-20080177077-A1 PROCESSES FOR THE PREPARATION OF 3-(4-(2,4-DIFLUOROBENZYLOXY)-3-BROMO-6-METHYL-2-OXOPYRIDIN-1(2H)-YL)-N,4-DIMETHYLBENZAMIDE CYP4X1, CYP4B1, KDM4B PSEN1 3711/4885PSEN2 2463/4885APH1B 3849/4885

“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.