SCHEMBL5317191

SCHEMBL5317191

N#Cc1ccc(CNC(=O)CN2CC3CN(Cc4ccc(OC(F)F)cc4)CC(C2)O3)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.44
CYP2C19 P33261 1/20 0.39
DPP4 P27487 2/20 0.39
DPP8 Q6V1X1 1/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TSHR P16473 1/20 0.39
KCNH2 Q12809 1/20 0.39
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 1/20 0.37
GPR6 P46095 1/20 0.37
KMT2A Q03164 1/20 0.36
JAK2 O60674 2/20 0.36
JAK1 P23458 1/20 0.36
TYK2 P29597 1/20 0.36
JAK3 P52333 1/20 0.36
FAAH O00519 1/20 0.36
KCNA5 P22460 1/20 0.36
ACACB O00763 1/20 0.36

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
SCHEMBL5340709 0.91 KCNH2 (0.41) POLBCYP2C19LMNASMN1; SMN2TSHR
SCHEMBL5314851 0.89 POLB (0.53) POLBCYP2C19DPP4DPP8TSHR
SCHEMBL5314736 0.86 KMT2A (0.50) POLBSMN1; SMN2KMT2A
SCHEMBL5315856 0.85 POLB (0.49) POLBTSHRHTTALDH1A1KMT2A
SCHEMBL5318355 0.85 POLB (0.60) POLBDPP4DPP8LMNATSHR
SCHEMBL5314874 0.85 POLB (0.54) POLBLMNASMN1; SMN2TSHRHTT
SCHEMBL5315911 0.84 POLB (0.46) POLBCYP2C19DPP4SMN1; SMN2ALDH1A1
SCHEMBL5317559 0.82 CD274 (0.47) SMN1; SMN2KCNH2GPR6KMT2A
SCHEMBL5315852 0.82 PRKAA2 (0.47) POLBCYP2C19DPP4DPP8LMNA
SCHEMBL5316192 0.81 HTT (0.52) POLBTSHRHTTALDH1A1KMT2A

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-2007069986-A1 NEW OXABISPIDINE COMPOUNDS FOR THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2007-06-21 WO disclosed