SCHEMBL8092814

SCHEMBL8092814

CCN(CC)CCOc1ccc2cc(C(=O)O)ccc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 1/20 0.56
▸ ACHE P22303 1/20 0.56
▸ EBP Q15125 3/20 0.56
▸ SIGMAR1 Q99720 3/20 0.56
▸ MAOB P27338 1/20 0.56
▸ KDM4E B2RXH2 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ MAPT P10636 1/20 0.54
▸ CHRNA7 P36544 1/20 0.54
▸ THRA P10827 1/20 0.53
▸ LMNA P02545 1/20 0.51
▸ SCN1A P35498 1/20 0.51
▸ SCN2A Q99250 1/20 0.51
▸ SCN3A Q9NY46 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ IDH1 O75874 1/20 0.51
▸ KCNH2 Q12809 1/20 0.51
▸ EGFR P00533 1/20 0.51
▸ ESR1 P03372 1/20 0.51
▸ ERBB2 P04626 1/20 0.51

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
SCHEMBL30969216 0.87 EBP (0.55) BCHEACHEEBPSIGMAR1MAOB
SCHEMBL250102 0.86 EBP (0.69) BCHEACHEEBPSIGMAR1KDM4E
SCHEMBL8184959 0.86 EBP (0.54) BCHEACHEEBPSIGMAR1MAOB
SCHEMBL29625647 0.86 EBP (0.54) BCHEACHEEBPSIGMAR1MAOB
SCHEMBL8134642 0.85 KDM4E (0.69) BCHEACHEKDM4ETHRALMNA
Hydrochloric Acid SCHEMBL4465808 0.85 EBP (0.67) BCHEACHEEBPSIGMAR1KDM4E
SCHEMBL4299737 0.84 KMT2A (0.70) EBPSIGMAR1MAOBKDM4EKMT2A
SCHEMBL868230 0.83 KMT2A (0.69) KDM4EKMT2ATHRA
SCHEMBL6836190 0.83 TP53 (0.71) KDM4ETHRA
SCHEMBL465148 0.83 KDM4E (0.65) KDM4EKMT2ATHRA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114401935-B Ion channel antagonists/blockers and uses thereof 上海市东方医院(同济大学附属东方医院) 2024-04-05 — — CN disclosed
CN-114401935-A Ion channel antagonists/blockers and uses thereof 上海市东方医院(同济大学附属东方医院) 2022-04-26 — — CN disclosed
EP-0810206-B1 Substituted 2-naphthoylguanidines, process for their preparation, their use as medicament or diagnostic agent and medicament containing them HOECHST AG (DE) 2000-12-27 — — EP disclosed
US-6087304-A ANTIARRHYTHMIC PHARMACEUTICALS HAVING A CARDIOPROTECTIVE COMPONENT FOR INFARCT PROPHYLAXIS AND INFARCT TREATMENT AND FOR THE TREATMENT OF ANGINA PECTORIS HOECHST AKTIENGESELLSCHAFT (DE) 2000-07-11 — — US disclosed
CN-1167759-A Substd. 2-naphthoyl guanidines, their preparing method, use and drug contg. them HOECHST AG (DE) 1997-12-17 — — CN disclosed
EP-0810206-A1 Substituted 2-naphtoylguanidines, process for their preparation, their use as medicament or diagnostic agent and medicament containing them HOECHST AKTIENGESELLSCHAFT (DE) 1997-12-03 — — EP disclosed
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