SCHEMBL28061446

SCHEMBL28061446

CCCCCCCCCCCCCCCCc1c[nH]cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.47
HRH4 Q9H3N8 2/20 0.38
HRH3 Q9Y5N1 2/20 0.38
LPL P06858 3/20 0.35
LIPG Q9Y5X9 3/20 0.35
ALDH1A1 P00352 2/20 0.35
PKM P14618 1/20 0.35
HPGD P15428 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
MGLL Q99685 1/20 0.35
PTGS2 P35354 3/20 0.34
ESR1 P03372 2/20 0.34
ADRA2A P08913 2/20 0.34
ADORA3 P0DMS8 2/20 0.34
TACR2 P21452 2/20 0.34
SLC6A2 P23975 2/20 0.34
SLC6A4 P31645 2/20 0.34
SLC6A3 Q01959 2/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL360634 1.00 KCNH2 (0.47) KCNH2HRH4HRH3LPLLIPG
SCHEMBL675808 1.00 KCNH2 (0.47) KCNH2HRH4HRH3LPLLIPG
SCHEMBL2697514 1.00 KCNH2 (0.47) KCNH2HRH4HRH3LPLLIPG
SCHEMBL2695561 1.00 KCNH2 (0.47) KCNH2HRH4HRH3LPLLIPG
SCHEMBL2696007 1.00 KCNH2 (0.47) KCNH2HRH4HRH3LPLLIPG
SCHEMBL674217 1.00 KCNH2 (0.47) KCNH2HRH4HRH3LPLLIPG
SCHEMBL2696234 1.00 KCNH2 (0.47) KCNH2HRH4HRH3LPLLIPG
SCHEMBL31554343 1.00 KCNH2 (0.47) KCNH2HRH4HRH3LPLLIPG
SCHEMBL2697904 1.00 KCNH2 (0.47) KCNH2HRH4HRH3LPLLIPG
Bromide SCHEMBL30689262 0.98 KCNH2 (0.46) KCNH2HRH4HRH3LPLLIPG

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
US-20250311759-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2025-10-09 US claimed
CN-119836236-A Organic compound 奇华顿股份有限公司 2025-04-15 CN claimed
US-20250311759-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2025-10-09 US disclosed
CN-119836236-A Organic compound 奇华顿股份有限公司 2025-04-15 CN disclosed
CN-105524276-B A kind of imidazoles quaternary cation flocculant and preparation method thereof 辽宁石油化工大学 2018-04-13 CN disclosed
CN-105524276-A Imidazole quaternary ammonium salt cationic flocculant and preparation method thereof UNIV LIAONING SHIHUA 2016-04-27 CN disclosed