SCHEMBL2807227

SCHEMBL2807227

CCCc1cc(Cl)nc(Nc2cccc(C(F)(F)F)c2)n1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IDH2 P48735 8/20 0.58
APP P05067 4/20 0.55
MAPT P10636 3/20 0.53
LMNA P02545 2/20 0.53
MAPK1 P28482 1/20 0.53
AURKA O14965 2/20 0.50
CTSC P53634 1/20 0.47

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
SCHEMBL2856487 0.84 IDH2 (0.71) IDH2APPMAPTLMNAMAPK1
SCHEMBL1391062 0.81 APP (0.65) IDH2APPMAPTLMNAMAPK1
SCHEMBL12484581 0.80 STK17A (0.46) APPMAPTLMNACTSC
SCHEMBL12485617 0.79 IDH2 (0.62) IDH2MAPTLMNAMAPK1
SCHEMBL12486143 0.78 CTSS (0.48)
SCHEMBL12485625 0.77 USP2 (0.60) IDH2MAPT
SCHEMBL12483182 0.77 KCNH3 (0.48) APPMAPTLMNAMAPK1
Hydrochloric Acid SCHEMBL17698146 0.77 USP2 (0.59) IDH2MAPT
SCHEMBL30568814 0.76 APP (0.79) IDH2APPMAPTLMNAMAPK1
SCHEMBL1391344 0.76 APP (0.79) IDH2APPMAPTLMNAMAPK1

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-2010118367-A2 ANTIVIRAL PYRIMIDINES PROGENICS PHARMACEUTICALS, INC. (US) 2010-10-14 WO disclosed