SCHEMBL9162000

SCHEMBL9162000

COC(C(=O)Cl)C(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.31

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
SCHEMBL21916633 0.77 ALDH1A1 (0.32) ACHE
SCHEMBL6931998 0.77 SLC1A3 (0.36) ACHE
SCHEMBL6932001 0.77 SLC1A3 (0.36) ACHE
SCHEMBL9196637 0.77 SLC1A3 (0.36) ACHE
SCHEMBL9300841 0.76 TSHR (0.39)
SCHEMBL6289513 0.75 ACHE (0.31) ACHE
SCHEMBL8600469 0.75 ACHE (0.45) ACHE
SCHEMBL21881710 0.75 ACHE (0.31) ACHE
SCHEMBL8600304 0.70 ALDH1A1 (0.39) ACHE
SCHEMBL15094167 0.69 ACHE (0.41) ACHE

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
JP-2036177-A None JP disclosed
EP-0347066-B1 New enantiomers and their isolation LUNDBECK & CO AS H (DK) 1995-03-15 EP disclosed
US-RE34712-E Pharmaceutically useful (+)-1-(3-dimethylaminopropyl)-1-(4'-fluorophenyl)-1,3-dihydroiso benzofuran-5-carbonitrile and non-toxic acid addition salts thereof H. LUNDBECK A/S (DK) 1994-08-30 US disclosed
US-4943590-A ANTIDEPRESSANTS, STEREOSPECIFIC SYNTHESIS H. LUNDBECK A/S (DK) 1990-07-24 US disclosed
JP-H0236177-A NEW ENANTIOMER AND METHOD FOR ISOLATING IT H LUNDBECK AS 1990-02-06 JP disclosed
EP-0340153-A1 N-substituted imidazoles, process for their preparation and their use in medicaments SCHERING AKTIENGESELLSCHAFT (DE) 1989-11-02 EP disclosed