SCHEMBL9833980

SCHEMBL9833980

NC(=O)C1CCCN(CCOC(c2ccc(F)cc2)c2ccc(F)cc2)C1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
SLC6A1 P30531 1/20 0.53
SLC6A4 P31645 2/20 0.52
SLC6A3 Q01959 2/20 0.52
SLC6A2 P23975 1/20 0.52

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
SCHEMBL10043038 0.92 BCHE (0.51) SLC6A1SLC6A4SLC6A3SLC6A2
SCHEMBL9835834 0.89 GAA (0.61) SLC6A4SLC6A3SLC6A2
SCHEMBL12748169 0.79 SIGMAR1 (0.53) SLC6A4SLC6A3
SCHEMBL9835308 0.79 SLC6A1 (0.63) SLC6A1
SCHEMBL9714856 0.78 CYP3A4 (0.59) SLC6A1SLC6A4SLC6A3SLC6A2
SCHEMBL9834615 0.78 SLC6A1 (0.59) SLC6A1
SCHEMBL8647649 0.77 LMNA (0.83) LMNANPSR1SLC6A4SLC6A3SLC6A2
SCHEMBL8642037 0.77 LMNA (0.78) LMNANPSR1SLC6A4SLC6A3SLC6A2
SCHEMBL8645362 0.76 LMNA (0.81) LMNANPSR1SLC6A4SLC6A3SLC6A2
SCHEMBL6082540 0.75 GAA (0.78)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0221572-B1 N-SUBSTITUTED 3-PIPERIDINE-OR 3-PYRIDINE-CARBOXYLIC ACIDS AND DERIVATIVES THEREOF WARNER-LAMBERT COMPANY (US) 1991-09-25 EP claimed