SCHEMBL9640989

SCHEMBL9640989

CCCCCCCCN(C)Cc1ccc(CCCC)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 5/20 0.66
▸ TMEM97 Q5BJF2 1/20 0.53
▸ KCNH2 Q12809 4/20 0.50
▸ ESR1 P03372 2/20 0.48
▸ ADRA2A P08913 2/20 0.48
▸ ADORA3 P0DMS8 2/20 0.48
▸ TACR2 P21452 2/20 0.48
▸ SLC6A2 P23975 2/20 0.48
▸ SLC6A4 P31645 2/20 0.48
▸ SLC6A3 Q01959 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ SHBG P04278 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ HSPD1 P10809 1/20 0.48
▸ ADRB3 P13945 1/20 0.48
▸ HTR2C P28335 1/20 0.48
▸ HSPE1 P61604 1/20 0.48

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
SCHEMBL7764359 0.92 SIGMAR1 (0.58) SIGMAR1TMEM97KCNH2KDM4EALDH1A1
SCHEMBL7764937 0.92 SIGMAR1 (0.58) SIGMAR1TMEM97KCNH2KDM4EALDH1A1
SCHEMBL8724611 0.92 SIGMAR1 (0.58) SIGMAR1TMEM97KCNH2KDM4EALDH1A1
SCHEMBL7768067 0.92 SIGMAR1 (0.58) SIGMAR1TMEM97KCNH2KDM4EALDH1A1
SCHEMBL8720392 0.92 SIGMAR1 (0.58) SIGMAR1TMEM97KCNH2KDM4EALDH1A1
SCHEMBL8722902 0.92 SIGMAR1 (0.58) SIGMAR1TMEM97KCNH2KDM4EALDH1A1
SCHEMBL8720913 0.92 SIGMAR1 (0.58) SIGMAR1TMEM97KCNH2KDM4EALDH1A1
SCHEMBL7128368 0.90 SIGMAR1 (0.55) SIGMAR1TMEM97KCNH2KDM4EALDH1A1
SCHEMBL15745552 0.87 SIGMAR1 (0.53) SIGMAR1TMEM97KCNH2KDM4EALDH1A1
SCHEMBL16421936 0.87 SIGMAR1 (0.53) SIGMAR1TMEM97KCNH2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250304543-A1 PROCESS FOR MAKING A SUBSTANTIALLY NITROSAMINE-FREE, SUBSTANTIALLY PEROXIDE-FREE, SUBSTANTIALLY COLORLESS AMINE OXIDE BASF SE (DE) 2025-10-02 — — US disclosed
EP-4536645-A1 PROCESS FOR MAKING A SUBSTANTIALLY NITROSAMINE-FREE, SUBSTANTIALLY PEROXIDE-FREE, SUBSTANTIALLY COLORLESS AMINE OXIDE BASF SE (DE) 2025-04-16 — — EP disclosed
CN-119365447-A Process for preparing substantially nitrosamine-free, peroxide-free, substantially colorless amine oxide 巴斯夫欧洲公司 2025-01-24 — — CN disclosed
WO-2023237729-A1 PROCESS FOR MAKING A SUBSTANTIALLY NITROSAMINE-FREE, SUBSTANTIALLY PEROXIDE-FREE, SUBSTANTIALLY COLORLESS AMINE OXIDE BASF SE (DE) 2023-12-14 — — WO disclosed
EP-0320694-B1 AMINE OXIDE PROCESS ETHYL CORPORATION (US) 1992-09-16 — — EP disclosed
EP-0424965-A1 Amine oxide process ETHYL CORPORATION (US) 1991-05-02 — — EP disclosed
US-4994614-A Reacting tertiary amines with aqueous hydrogen peroxide in presence of synergistic combination of ascorbic acid and carbon dioxide; purity ETHYL CORPORATION (US) 1991-02-19 — — US disclosed
US-4960934-A Amine oxide process ETHYL CORPORATION (US) 1990-10-02 — — US disclosed
US-4942260-A REACTION OF A TERT-AMINE WITH HYDROGEN PEROXIDE IN THE PRESENCE OF CATALYTIC CARBON DIOXIDE ETHYL CORPORATION (US) 1990-07-17 — — US disclosed
EP-0356918-A1 Amine oxide process ETHYL CORPORATION (US) 1990-03-07 — — EP disclosed
US-4889954-A DIALKYLCARBONATE CATALYST ETHYL CORPORATION (US) 1989-12-26 — — US disclosed
EP-0320694-A2 Amine oxide process ETHYL CORPORATION (US) 1989-06-21 — — EP disclosed
EP-0307184-A2 Preparation of Amine Oxides ETHYL CORPORATION (US) 1989-03-15 — — EP disclosed
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