SCHEMBL317432

SCHEMBL317432

COc1c(Cl)cc[n+]([O-])c1C

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HSD17B10 Q99714 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.31
TSHR P16473 1/20 0.30
MAPK14 Q16539 1/20 0.30

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
SCHEMBL30297897 1.00 ALDH1A1 (0.36) ALDH1A1KDM4EHSD17B10L3MBTL1TSHR
SCHEMBL3183642 0.87
SCHEMBL1003702 0.78 ACHE (0.37) ALDH1A1KDM4EMAPK14
SCHEMBL30147933 0.76 ALDH1A1 (0.34) ALDH1A1
SCHEMBL712432 0.76 ALDH1A1 (0.34) ALDH1A1
SCHEMBL13729104 0.76 ALDH1A1 (0.40) ALDH1A1KDM4EHSD17B10L3MBTL1TSHR
SCHEMBL4264731 0.76 ALDH1A1 (0.33) ALDH1A1KDM4EHSD17B10TSHR
SCHEMBL10668912 0.74 ALDH1A1 (0.41) ALDH1A1KDM4EHSD17B10L3MBTL1TSHR
SCHEMBL8882728 0.73 POLB (0.42) ALDH1A1KDM4EL3MBTL1
SCHEMBL191237 0.72 MAPK14 (0.33) ALDH1A1KDM4EMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107129466-B Synthesis method of 4-chloro-3-methoxy-2-methylpyridine-N-oxide 滁州学院 2020-11-13 CN claimed
EP-1335913-B1 A PROCESS FOR THE PREPARATION OF PANTOPRAZOLE AND INTERMEDIATES THEREFOR DINAMITE DIPHARMA SPA (IT) 2004-09-08 EP claimed
US-20040049044-A1 Process for the preparation of pantoprazole and intermediates therefor DINAMITE DIPHARMA (DIPHARMA S.P.A.) (IT) 2004-03-11 US claimed
EP-1335913-A1 A PROCESS FOR THE PREPARATION OF PANTOPRAZOLE AND INTERMEDIATES THEREFOR Dinamite Dipharma S.p.A. (in abbreviated form Dipharma S.p.A.) (IT) 2003-08-20 EP claimed
WO-2002028852-A1 A PROCESS FOR THE PREPARATION OF PANTOPRAZOLE AND INTERMEDIATES THEREFOR DINAMITE DIPHARMA (IT) 2002-04-11 WO claimed
US-20250163078-A1 IMIDAZOPYRIDAZINE DERIVATIVE, AND PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF Shanghai Simr Biotechnology Co., Ltd. (CN) 2025-05-22 US disclosed
EP-4484433-A1 IMIDAZOPYRIDAZINE DERIVATIVE, AND PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF Shanghai Simr Biotechnology Co., Ltd. (CN) 2025-01-01 EP disclosed
CN-116693555-A Imidazopyridazine derivative, preparation method, pharmaceutical composition and application thereof 上海赛默罗生物科技有限公司 2023-09-05 CN disclosed
WO-2023160475-A1 IMIDAZOPYRIDAZINE DERIVATIVE, AND PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF 上海赛默罗生物科技有限公司 2023-08-31 WO disclosed
CN-107129466-B Synthesis method of 4-chloro-3-methoxy-2-methylpyridine-N-oxide 滁州学院 2020-11-13 CN disclosed
CN-107129466-B Synthesis method of 4-chloro-3-methoxy-2-methylpyridine-N-oxide 滁州学院 2020-11-13 CN disclosed
CN-107129466-B Synthesis method of 4-chloro-3-methoxy-2-methylpyridine-N-oxide 滁州学院 2020-11-13 CN disclosed
US-5922720-A PHARMACEUTICAL FOR USE IN TREATMENT OF DISEASES BASED ON HELICOBACTER BACTERIA BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1999-07-13 US disclosed
US-5859030-A Substituted arylalkylthioalkylthiopyridines for use in the control of helicobacter bacteria BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1999-01-12 US disclosed
US-5773451-A BACTERICIDES FOR HELICOBACTER BACTERIA BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1998-06-30 US disclosed
US-5658933-A Substituted heterocyclic carboxamide esters, their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1997-08-19 US disclosed
US-5587389-A Substituted heteroarylaklylthiopyridines for controlling helicobacter bacteria BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1996-12-24 US disclosed
US-5430042-A Dialkoxy-pyridinyl-benzimidazole derivatives, process for their preparation and their pharmaceutical use AKTIEBOLAGET ASTRA (SE) 1995-07-04 US disclosed
EP-0593463-A1 DIALKOXY-PYRIDINYL-BENZIMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL USE AKTIEBOLAGET ASTRA (SE) 1994-04-27 EP disclosed
WO-1991019712-A1 DIALKOXY-PYRIDINYL-BENZIMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL USE AKTIEBOLAGET ASTRA (SE) 1991-12-26 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 (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-20250163078-A1 IMIDAZOPYRIDAZINE DERIVATIVE, AND PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF CYP4A11, CYP4F11, SLC6A11 ALDH1A1 437/4885KDM4E 3724/4885HSD17B10 1558/4885
US-20040049044-A1 Process for the preparation of pantoprazole and intermediates therefor CYP4F11, CYP2F1, POR ALDH1A1 301/4885KDM4E 4077/4885HSD17B10 928/4885

“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.