SCHEMBL3162903

SCHEMBL3162903

O=C(CBr)c1ccc(F)c(Br)c1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 6/20 0.57
GSK3B P49841 12/20 0.53
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MAOB P27338 1/20 0.40

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
SCHEMBL31149832 1.00 PTPN1 (0.57) PTPN1GSK3BCES2CES1NPC1
SCHEMBL2953875 0.85 PTPN1 (0.57) PTPN1GSK3BCES2CES1MAOB
SCHEMBL246840 0.85 ACHE (0.42) PTPN1GSK3BCES2CES1NPC1
SCHEMBL28037289 0.85 CES2 (0.41) PTPN1GSK3BCES2CES1NPC1
SCHEMBL29628387 0.84 PTPN1 (0.61) PTPN1GSK3BCES2CES1NPC1
SCHEMBL366866 0.84 PTPN1 (0.61) PTPN1GSK3BCES2CES1NPC1
SCHEMBL3013333 0.83 MAPT (0.50) NPC1RAB9A
SCHEMBL3995406 0.82 GSK3B (0.59) PTPN1GSK3B
SCHEMBL5378544 0.80 KMT2A (0.49) NPC1RAB9A
SCHEMBL2555281 0.80 MAOB (0.40) PTPN1CES2CES1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115484825-B Phenyl compound and method for controlling plant disease 住友化学株式会社 2025-06-24 CN disclosed
CN-115484825-A Phenyl compound and method for controlling plant disease 住友化学株式会社 2022-12-16 CN disclosed
WO-2021215480-A1 PHENYL COMPOUND AND PLANT DISEASE CONTROL METHOD 住友化学株式会社 (JP) 2021-10-28 WO disclosed
US-10442788-B2 Hepatitis B antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2019-10-15 US disclosed
US-10301255-B2 Hepatitis B antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2019-05-28 US disclosed
US-20170022150-A1 HEPATITIS B ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2017-01-26 US disclosed
WO-2017015451-A1 HEPATITIS B ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. (US) 2017-01-26 WO disclosed
WO-2016161268-A1 HEPATITIS B ANTVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. (US) 2016-10-06 WO disclosed
US-20160289212-A1 HEPATITIS B ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2016-10-06 US disclosed
EP-2758380-B1 BENZOIC ACID DERIVATIVES AS EIF4E INHIBITORS HOFFMANN LA ROCHE (CH) 2015-10-21 EP disclosed
US-20040220194-A1 2-Alkynyl-and 2-alkenyl-pyrazolo-[4,3-e]-1,2,4-triazolo-[1,5-c]-pyrimidine adenosine A2a receptor antagonists SCHERING CORPORATION 2004-11-04 US disclosed
US-20040220194-A1 2-Alkynyl-and 2-alkenyl-pyrazolo-[4,3-e]-1,2,4-triazolo-[1,5-c]-pyrimidine adenosine A2a receptor antagonists SCHERING CORPORATION 2004-11-04 US disclosed
US-20040180921-A1 Substituted imidazo[1,2-a]pyridine derivatives MUTEL VINCENT (FR) 2004-09-16 US disclosed
US-20040072876-A1 Substituted thiazole derivatives bearing 3-pyridyl groups, process for preparing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-15 US disclosed
EP-1381363-A1 IMIDAZO [1,2-A]-PYRIDINE DERIVATIVES AS MGLUR5 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-01-21 EP disclosed
US-20030212096-A1 Substituted imidazo [1,2-a] pyridine derivatives MUTEL VINCENT (FR) 2003-11-13 US disclosed
EP-1348706-A1 SUBSTITUTED THIAZOLE DERIVATIVES BEARING 3-PYRIDYL GROUPS, PROCESS FOR PREPARING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-10-01 EP disclosed
US-6596731-B2 An imidazo(1,2-a)pyridine derivative useful for treating chronical or acute neurological disorders, cognitive disorders and memory deficits HOFFMANN-LA ROCHE INC. 2003-07-22 US disclosed
US-20020188128-A1 Substituted imidazo[1,2-A] pyridine derivatives F.HOFFMANN-LA ROCHE AG (CH) 2002-12-12 US disclosed
WO-2002092086-A1 IMIDAZO (1,2-A)-PYRIDINE DERIVATIVES AS MGLUR5 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2002-11-21 WO 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 (9 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-10301255-B2 Hepatitis B antiviral agents HAVCR2, ZC3HAV1, SLC10A1 PTPN1 1304/4885GSK3B 149/4885CES2 1700/4885
US-20160289212-A1 HEPATITIS B ANTIVIRAL AGENTS ZC3HAV1, HAVCR2, SLC10A1 PTPN1 645/4885GSK3B 76/4885CES2 2119/4885
US-20040072876-A1 Substituted thiazole derivatives bearing 3-pyridyl groups, process for preparing the same and use thereof CYP17A1, CYP21A2, HSD17B1 PTPN1 769/4885GSK3B 1171/4885CES2 840/4885
US-20170022150-A1 HEPATITIS B ANTIVIRAL AGENTS HAVCR2, ZC3HAV1, SLC10A1 PTPN1 1304/4885GSK3B 149/4885CES2 1700/4885
US-20030212096-A1 Substituted imidazo [1,2-a] pyridine derivatives GRM5, GRM1, GRIK5 PTPN1 745/4885GSK3B 3738/4885CES2 1935/4885
US-20040220194-A1 2-Alkynyl-and 2-alkenyl-pyrazolo-[4,3-e]-1,2,4-triazolo-[1,5-c]-pyrimidine adenosine A2a receptor antagonists ADORA2A, ADORA3, ADORA1 PTPN1 1920/4885GSK3B 2185/4885CES2 1479/4885
US-20040180921-A1 Substituted imidazo[1,2-a]pyridine derivatives GRM5, GRM1, GRIK5 PTPN1 745/4885GSK3B 3738/4885CES2 1935/4885
US-10442788-B2 Hepatitis B antiviral agents ZC3HAV1, ZC3HAV1L, HAVCR2 PTPN1 659/4885GSK3B 79/4885CES2 2136/4885
US-20020188128-A1 Substituted imidazo[1,2-A] pyridine derivatives GRM5, GRM1, GRIK5 PTPN1 745/4885GSK3B 3738/4885CES2 1935/4885

“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.