SCHEMBL30154550

SCHEMBL30154550

Cc1cc(Cc2nc3cnc4ccc(C(F)F)cc4c3n2[C@@H]2CCO[C@H](C)C2)no1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 20/20 1.00

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
SCHEMBL24027165 1.00 LRRK2 (1.00) LRRK2
Trifluoroacetic Acid SCHEMBL30231364 0.94 LRRK2 (0.88) LRRK2
SCHEMBL25020894 0.90 LRRK2 (0.81) LRRK2
SCHEMBL30154559 0.89 LRRK2 (1.00) LRRK2
SCHEMBL24027295 0.89 LRRK2 (1.00) LRRK2
SCHEMBL18658931 0.89 LRRK2 (0.80) LRRK2
SCHEMBL18623749 0.89 LRRK2 (0.80) LRRK2
SCHEMBL18606414 0.87 LRRK2 (0.78) LRRK2
SCHEMBL18606494 0.87 LRRK2 (0.80) LRRK2
SCHEMBL18606516 0.87 LRRK2 (0.78) LRRK2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111051304-B Imidazo [4,5-c ] quinoline derivatives as LRRK2 inhibitors 辉瑞大药厂 2022-12-27 CN claimed
CN-111051304-B Imidazo [4,5-c ] quinoline derivatives as LRRK2 inhibitors 辉瑞大药厂 2022-12-27 CN disclosed