SCHEMBL26164228

SCHEMBL26164228

CCc1cc2c(cc1Nc1ncc(C(F)(F)F)c(-c3cc4c(s3)CCNC4=O)n1)CN(C)C2

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 6/20 0.37
▸ MAP4K1 Q92918 6/20 0.36
▸ TNK2 Q07912 3/20 0.36
▸ PTK2 Q05397 2/20 0.35
▸ FLT4 P35916 1/20 0.35
▸ ULK1 O75385 1/20 0.35
▸ ULK2 Q8IYT8 1/20 0.35
▸ CDC7 O00311 1/20 0.35
▸ DBF4 Q9UBU7 1/20 0.35
▸ MAP4K3 Q8IVH8 1/20 0.35
▸ PLK1 P53350 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
SCHEMBL25210979 0.88 MAP4K1 (0.40) MAP4K1PTK2FLT4CDC7DBF4
SCHEMBL30412210 0.88 MAP4K1 (0.40) MAP4K1PTK2FLT4CDC7DBF4
SCHEMBL30412660 0.88 MERTK (0.38) PTK2
SCHEMBL25208657 0.88 MERTK (0.38) PTK2
SCHEMBL30412558 0.86 ULK1 (0.51) TNK2PTK2FLT4ULK1ULK2
SCHEMBL25205428 0.86 ULK1 (0.51) TNK2PTK2FLT4ULK1ULK2
SCHEMBL26164230 0.84 MAP4K1 (0.42) LRRK2MAP4K1TNK2PTK2ULK1
SCHEMBL25197714 0.81 MAP4K1 (0.44) LRRK2MAP4K1TNK2PTK2MAP4K3
SCHEMBL30412113 0.81 MAP4K1 (0.44) LRRK2MAP4K1TNK2PTK2MAP4K3
SCHEMBL25216242 0.80 MAP4K1 (0.41) MAP4K1TNK2PTK2FLT4MAP4K3

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
WO-2023215494-A1 THIOPHENE ULK1/2 INHIBITORS AND THEIR USE THEREOF ERASCA, INC. (US) 2023-11-09 — — WO disclosed
WO-2023087027-A1 THIOPHENE ULK1/2 INHIBITORS AND THEIR USE THEREOF ERASCA, INC. (US) 2023-05-19 — — WO disclosed
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