SCHEMBL193501

SCHEMBL193501

O=C(CBr)c1ccc(Br)s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 5/20 1.00
CES2 O00748 1/20 0.61
CES1 P23141 1/20 0.61
DAO P14920 1/20 0.59
NPSR1 Q6W5P4 3/20 0.52
RXFP1 Q9HBX9 3/20 0.52
GAA P10253 1/20 0.52
KDM4E B2RXH2 2/20 0.50
ESR1 P03372 2/20 0.50
ALDH1A1 P00352 5/20 0.48
POLB P06746 2/20 0.47
HPGD P15428 2/20 0.47
KMT2A Q03164 5/20 0.46
MEN1 O00255 3/20 0.45
RAB9A P51151 2/20 0.45
MAPT P10636 3/20 0.44
ALOX12 P18054 1/20 0.44
PPARG P37231 1/20 0.44
NCOA2 Q15596 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL5147503 0.85 GSK3B (0.72) GSK3BCES2CES1DAONPSR1
SCHEMBL15988673 0.84 GSK3B (0.73) GSK3BCES2CES1DAONPSR1
SCHEMBL10844749 0.83 GSK3B (0.70) GSK3BCES2CES1DAONPSR1
SCHEMBL11606690 0.81 GSK3B (0.68) GSK3BCES2CES1DAOALDH1A1
SCHEMBL3472612 0.81 GSK3B (0.68) GSK3BCES2CES1DAONPSR1
SCHEMBL847050 0.81 GSK3B (0.68) GSK3BCES2CES1DAONPSR1
SCHEMBL3998532 0.81 GSK3B (1.00) GSK3BCES2CES1DAONPSR1
SCHEMBL1359642 0.80 GSK3B (0.67) GSK3BGAAKDM4EALDH1A1POLB
SCHEMBL18153171 0.78 GSK3B (0.64) GSK3BDAOPOLBKMT2AMEN1
SCHEMBL6847233 0.78 GSK3B (0.63) GSK3BCES2CES1DAONPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4731216-A1 HETEROARYL-AMINE COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS Augustine Therapeutics (BE) 2026-04-29 EP disclosed
WO-2024261327-A1 2-(HETEROARYL-THIO)-1-(HETEROARYL)ETHANONE COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS AUGUSTINE THERAPEUTICS (BE) 2024-12-26 WO disclosed
WO-2024261329-A1 HETEROARYL-AMINE COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS AUGUSTINE THERAPEUTICS (BE) 2024-12-26 WO disclosed
US-11584742-B2 Substituted aminothiazoles as inhibitors of nucleases MASARYKOVA UNIVERZITA (CZ) 2023-02-21 US disclosed
US-20220002282-A1 SUBSTITUTED AMINOTHIAZOLES AS INHIBITORS OF NUCLEASES MASARYKOVA UNIVERZITA (CZ) 2022-01-06 US disclosed
EP-3556755-B1 SUBSTITUTED AMINOTHIAZOLES AS INHIBITORS OF NUCLEASES UNIV MASARYKOVA (CZ) 2021-11-17 EP disclosed
CN-112313229-A Substituted aminothiazoles as inhibitors of nucleases 马萨里克大学 2021-02-02 CN disclosed
US-10752611-B2 Benzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2020-08-25 US disclosed
EP-3556755-A1 SUBSTITUTED AMINOTHIAZOLES AS INHIBITORS OF NUCLEASES Masarykova univerzita (CZ) 2019-10-23 EP disclosed
US-10017499-B2 Benzimidazole derivatives ENANTA PHARMACEUTICALS, INC. (US) 2018-07-10 US disclosed
EP-0571253-B1 Benzimidazole derivatives with antidiabetic and antiplatelet aggregation activity ADIR (FR) 1998-11-04 EP disclosed
EP-0816352-A1 Bi-aryl heterocyclic compounds and their use in human or veterinary medicine and in cosmetics CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) 1998-01-07 EP disclosed
US-5639756-A ANTIDIABETIC AGENTS ADIR ET COMPAGNIE (FR) 1997-06-17 US disclosed
US-5623073-A ANTIDIABETIC AGENT ADIR ET COMPAGNIE (FR) 1997-04-22 US disclosed
US-5502070-A INSECTICIDES, MITICIDES, PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-03-26 US disclosed
EP-0591785-A1 Substituted 3,4-hetarylpyrazolines, process for their preparation and their use as pesticides BAYER AG (DE) 1994-04-13 EP disclosed
EP-0571253-A1 Benzimidazole derivatives with antidiabetic and antiplatelet aggregation activity ADIR ET COMPAGNIE (FR) 1993-11-24 EP disclosed
US-4596815-A Fungicides BAYER AKTIENGESELLSCHAFT (DE) 1986-06-24 US disclosed
US-4105663-A HYPOTENSIVE, BLOCKING AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1978-08-08 US disclosed
US-4093628-A HYPOTENSIVE AGENTS, BLOCKING AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1978-06-06 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-11584742-B2 Substituted aminothiazoles as inhibitors of nucleases RNASEH1, DNASE1, FEN1 GSK3B 3281/4885CES2 3987/4885CES1 3169/4885
US-10017499-B2 Benzimidazole derivatives EIF2AK2, ZC3HAV1, ZC3HAV1L GSK3B 865/4885CES2 417/4885CES1 79/4885
US-20220002282-A1 SUBSTITUTED AMINOTHIAZOLES AS INHIBITORS OF NUCLEASES RNASEH1, DNASE1, FEN1 GSK3B 3281/4885CES2 3987/4885CES1 3169/4885
US-10752611-B2 Benzimidazole derivatives EIF2AK2, ZC3HAV1, ZC3HAV1L GSK3B 865/4885CES2 417/4885CES1 79/4885

“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.