SCHEMBL20537443

SCHEMBL20537443

CCOc1nc(Nc2ccc(C3CN(C=O)CCO3)cc2OC)ncc1Cl

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 10/20 0.47
ALK Q9UM73 3/20 0.45
INSR P06213 2/20 0.45
EGFR P00533 7/20 0.44
IGF1R P08069 1/20 0.44

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
SCHEMBL20537247 0.93 LRRK2 (0.54) LRRK2ALKINSREGFRIGF1R
SCHEMBL20537246 0.92 LRRK2 (0.49) LRRK2ALKINSREGFRIGF1R
SCHEMBL20537315 0.91 LRRK2 (0.48) LRRK2ALKEGFR
SCHEMBL20537441 0.90 LRRK2 (0.57) LRRK2ALKINSREGFRIGF1R
SCHEMBL19304965 0.88 LRRK2 (0.43) LRRK2ALKINSREGFR
SCHEMBL17644540 0.87 LRRK2 (0.59) LRRK2
SCHEMBL17644564 0.87 LRRK2 (0.51) LRRK2ALKINSREGFRIGF1R
SCHEMBL15022377 0.87 LRRK2 (0.56) LRRK2ALKINSREGFRIGF1R
SCHEMBL20537463 0.87 LRRK2 (0.49) LRRK2ALK
SCHEMBL20537313 0.85 LRRK2 (0.55) LRRK2ALKEGFR

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-3075730-B1 AMINOPYRIMIDINE DERIVATIVES AS LRRK2 MODULATORS GENENTECH INC (US) 2018-10-24 EP claimed