SCHEMBL19730075

SCHEMBL19730075

Ic1n[nH]c2ccnc(NC3CCOCC3)c12

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 19/20 0.66
UTS2R Q9UKP6 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
SCHEMBL16517163 0.90 LRRK2 (0.54) LRRK2UTS2R
SCHEMBL416713 0.84 LRRK2 (0.66) LRRK2UTS2R
SCHEMBL883177 0.83 LRRK2 (0.63) LRRK2UTS2R
SCHEMBL883178 0.81 LRRK2 (0.67) LRRK2
SCHEMBL878306 0.80 LRRK2 (0.76) LRRK2UTS2R
SCHEMBL878305 0.80 LRRK2 (0.59) LRRK2UTS2R
SCHEMBL883244 0.80 LRRK2 (1.00) LRRK2
SCHEMBL15267024 0.78 LRRK2 (1.00) LRRK2UTS2R
SCHEMBL15266515 0.77 LRRK2 (0.74) LRRK2
SCHEMBL876020 0.77 LRRK2 (0.62) LRRK2UTS2R

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-2017215600-A1 SUBSTITUTED TRICYCLIC HERTEOCYCLIC COMPOUNDS AND USE THEREOF SUZHOU YABAO PHARMACEUTICAL R&D CO., LTD. (CN) 2017-12-21 WO disclosed