SCHEMBL25528899

SCHEMBL25528899

N/N=c1/c(N)nc(-c2ccc(F)cc2)c(-c2ccc3ncc(Cl)n3c2)n1N

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 20/20 0.43
▸ TGFBR2 P37173 5/20 0.40

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
SCHEMBL25528885 0.88 ADORA2A (0.44) TGFBR1TGFBR2
SCHEMBL25528897 0.86 TGFBR1 (0.60) TGFBR1TGFBR2
SCHEMBL25528895 0.86 TGFBR1 (0.54) TGFBR1TGFBR2
SCHEMBL25211299 0.78 TGFBR1 (0.42) TGFBR1TGFBR2
SCHEMBL25528877 0.75 ADORA2A (0.45) —
SCHEMBL25528249 0.74 ADORA2A (0.52) —
SCHEMBL22125562 0.71 TGFBR1 (0.45) TGFBR1TGFBR2
SCHEMBL25528890 0.69 MAPK14 (0.47) —
SCHEMBL25528952 0.69 ADORA2A (0.55) TGFBR1
SCHEMBL25528882 0.69 SMN1; SMN2 (0.39) —

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-2023091604-A1 ADENOSINE RECEPTOR ANTAGONISTS CROSSIGNAL THERAPEUTICS, INC. (US) 2023-05-25 — — WO disclosed
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