SCHEMBL30860782

SCHEMBL30860782

CNc1nc(Nc2ccc(Br)c3[nH]ncc23)ncc1C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 18/20 0.51
▸ CYP1A2 P05177 6/20 0.49
▸ ULK1 O75385 2/20 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
SCHEMBL27228045 1.00 LRRK2 (0.51) LRRK2CYP1A2ULK1
SCHEMBL27227971 0.88 LRRK2 (0.53) LRRK2CYP1A2ULK1
SCHEMBL30860843 0.88 LRRK2 (0.52) LRRK2CYP1A2ULK1
SCHEMBL30861027 0.88 LRRK2 (0.53) LRRK2CYP1A2ULK1
SCHEMBL27227903 0.88 LRRK2 (0.52) LRRK2CYP1A2ULK1
SCHEMBL27228523 0.85 LRRK2 (0.62) LRRK2
SCHEMBL30861094 0.85 LRRK2 (0.62) LRRK2
SCHEMBL30860864 0.80 ULK1 (0.57) LRRK2CYP1A2ULK1
SCHEMBL30860933 0.80 LRRK2 (0.54) LRRK2CYP1A2ULK1
SCHEMBL27228375 0.80 ULK1 (0.57) LRRK2CYP1A2ULK1

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-2024073073-A2 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. (US) 2024-04-04 — — WO disclosed
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