SCHEMBL9864651

SCHEMBL9864651

CC[N+]1(CC)CCC1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL17550748 1.00 CHRNA7 (0.36)
SCHEMBL575435 0.92
SCHEMBL19307694 0.89 CHRNA7 (0.34)
SCHEMBL19307655 0.89 CHRNA7 (0.34)
Fluoride Ion SCHEMBL29251843 0.89 CHRNA7 (0.34)
SCHEMBL575098 0.89 CHRNA7 (0.34)
Iodide SCHEMBL8991344 0.89 CHRNA7 (0.34)
Hydrochloric Acid SCHEMBL15366520 0.89 CHRNA7 (0.34)
Water SCHEMBL16297127 0.89 CHRNA7 (0.34)
SCHEMBL2865219 0.89 CHRNA7 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4997978-A Preparation of alkyl carboxylates by hydrocarbonylation RHONE-POULENC INDUSTRIES (FR) 1991-03-05 US disclosed
EP-0070787-B1 PROCESS FOR THE CARBONYLATION OF METHYL ACETATE RHONE-POULENC CHIMIE DE BASE (FR) 1985-06-26 EP disclosed
US-4511517-A COBALT AND IRON SOURCE, IODIDE RHONE-POULENC CHIMIE DE BASE (FR) 1985-04-16 US disclosed
EP-0067777-B1 PROCESS FOR THE CARBONYLATION OF METHYL ACETATE RHONE-POULENC CHIMIE DE BASE (FR) 1985-04-10 EP disclosed
US-4500474-A Carbonylation of methyl acetate RHONE-POULENC CHIMIE DE BASE (FR) 1985-02-19 US disclosed
EP-0046129-B1 PROCESS FOR THE HYDROCARBONYLATION AND/OR CARBONYLATION OF ALKYL CARBOXYLATES RHONE-POULENC CHIMIE DE BASE (FR) 1984-04-04 EP disclosed
EP-0046128-B1 PROCESS FOR THE HYDROCARBONYLATION AND/OR CARBONYLATION OF ALKYL CARBOXYLATES RHONE-POULENC CHIMIE DE BASE (FR) 1984-04-04 EP disclosed
US-4431835-A USING A CATALYST COMPRISING COMPOUNDS OF RUTHENIUM, COBALT, CHROMIUM AND AN IODIDE PROMOTER RHONE-POULENC INDUSTRIES (FR) 1984-02-14 US disclosed
US-4430506-A CATALYST SYSTEM OF RUTHENIUM, COBALT, VANDIUM AND IODINE CONTAINING PROMOTER RHONE-POULENC INDUSTRIES (FR) 1984-02-07 US disclosed
EP-0031784-B1 PROCESS FOR PREPARING ETHYL CARBOXYLATES FROM THEIR LOWER HOMOLOGUES RHONE-POULENC CHIMIE DE BASE (FR) 1983-07-13 EP disclosed
EP-0070787-A1 Process for the carbonylation of methyl acetate RHONE-POULENC CHIMIE DE BASE (FR) 1983-01-26 EP disclosed
EP-0067777-A1 Process for the carbonylation of methyl acetate RHONE-POULENC CHIMIE DE BASE (FR) 1982-12-22 EP disclosed
EP-0022038-B1 PROCESS FOR THE HOMOLOGATION OF METHANOL RHONE-POULENC CHIMIE DE BASE (FR) 1982-09-15 EP disclosed
EP-0022735-B1 PROCESS FOR THE PREPARATION OF ACETALDEHYDE RHONE-POULENC CHIMIE DE BASE (FR) 1982-04-28 EP disclosed
US-4324927-A Process for the homologization of methanol RHONE-POULENC INDUSTRIES (FR) 1982-04-13 US disclosed
EP-0046129-A1 Process for the hydrocarbonylation and/or carbonylation of alkyl carboxylates RHONE-POULENC CHIMIE DE BASE (FR) 1982-02-17 EP disclosed
EP-0046128-A1 Process for the hydrocarbonylation and/or carbonylation of alkyl carboxylates RHONE-POULENC CHIMIE DE BASE (FR) 1982-02-17 EP disclosed
US-4306091-A CATALYTIC HYDROCARBONYLATION OF METHANOL IN THE PRESENCE OF COBALT, RUTHENIUM AND AN ALKYL HALIDE AND AN IONIC HALIDE RHONE-POULENC INDUSTRIES (FR) 1981-12-15 US disclosed
EP-0031784-A2 Process for preparing ethyl carboxylates from their lower homologues RHONE-POULENC CHIMIE DE BASE (FR) 1981-07-08 EP disclosed
EP-0022038-A1 Process for the homologation of methanol RHONE-POULENC CHIMIE DE BASE (FR) 1981-01-07 EP disclosed