SCHEMBL20208539

SCHEMBL20208539

Cc1cnc2ccc(-c3ccc(OC(F)(F)F)cc3)nn12

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 4/20 0.60
CYP1A2 P05177 3/20 0.60
DYRK1A Q13627 12/20 0.55
FYN P06241 2/20 0.48
CLK2 P49760 1/20 0.45
HASPIN Q8TF76 1/20 0.45

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
SCHEMBL20208536 0.84 SCN5A (0.60) SCN5ACYP1A2DYRK1AFYN
SCHEMBL20208538 0.84 SCN5A (0.64) SCN5ACYP1A2DYRK1AFYN
SCHEMBL937481 0.78 CYP1A2 (0.75) SCN5ACYP1A2DYRK1ACLK2HASPIN
SCHEMBL23535595 0.77 FYN (0.47) FYN
SCHEMBL16866295 0.76 FYN (0.59) DYRK1AFYN
SCHEMBL26539244 0.76 SCN5A (0.50) SCN5ACYP1A2FYN
SCHEMBL26745677 0.75 DYRK1A (0.83) DYRK1AFYN
SCHEMBL16866294 0.75 FYN (0.61) DYRK1AFYN
SCHEMBL937201 0.75 CYP1A2 (1.00) SCN5ACYP1A2DYRK1A
SCHEMBL20203775 0.74 CYP1A2 (0.76) SCN5ACYP1A2DYRK1ACLK2HASPIN

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
WO-2018098500-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. (US) 2018-05-31 WO disclosed