SCHEMBL26629467

SCHEMBL26629467

O=C(O)N1CC2CC1CN2c1ccc(Nc2ncc(C(F)(F)F)c(Cl)n2)c(C2CC2)c1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 8/20 0.43
▸ ALK Q9UM73 10/20 0.37
▸ IGF1R P08069 1/20 0.34
▸ CCR2 P41597 1/20 0.34

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
SCHEMBL25202448 1.00 LRRK2 (0.43) LRRK2ALKIGF1RCCR2
SCHEMBL25227805 1.00 LRRK2 (0.43) LRRK2ALKIGF1RCCR2
SCHEMBL30411855 0.93 LRRK2 (0.45) LRRK2ALK
SCHEMBL25224704 0.93 LRRK2 (0.45) LRRK2ALK
SCHEMBL30412450 0.89 ALK (0.43) LRRK2ALK
SCHEMBL30410928 0.89 ALK (0.43) LRRK2ALK
SCHEMBL25198593 0.89 PTK2 (0.40) LRRK2ALK
SCHEMBL26629481 0.89 PTK2 (0.40) LRRK2ALK
SCHEMBL26629380 0.88 ALK (0.40) LRRK2ALK
SCHEMBL25222599 0.88 LRRK2 (0.43) LRRK2ALK

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-2023215494-A1 THIOPHENE ULK1/2 INHIBITORS AND THEIR USE THEREOF ERASCA, INC. (US) 2023-11-09 — — WO disclosed
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