SCHEMBL24565450

SCHEMBL24565450

CCN(CCCOc1ccc(OC)c(Nc2nc(Nc3ccccc3P(C)(C)=O)c3cc[nH]c3n2)c1)C(C)C

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 1/20 0.57
▸ MAPK8 P45983 1/20 0.57
▸ MAP4K1 Q92918 1/20 0.54
▸ PTK2 Q05397 13/20 0.52
▸ TTK P33981 1/20 0.49
▸ GRK5 P34947 3/20 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
SCHEMBL24565465 0.87 PTK2 (0.55) PTK2
SCHEMBL24565236 0.78 IGF1R (0.58) IGF1RMAPK8MAP4K1PTK2TTK
SCHEMBL24565324 0.78 IGF1R (0.59) IGF1RMAPK8MAP4K1TTKGRK5
SCHEMBL24565244 0.77 IGF1R (0.59) IGF1RMAPK8MAP4K1PTK2TTK
SCHEMBL24565262 0.75 MAP4K1 (0.57) IGF1RMAPK8MAP4K1PTK2GRK5
SCHEMBL24565332 0.75 ALK (0.48) IGF1RMAP4K1
SCHEMBL24565184 0.74 ALK (0.51) IGF1RMAP4K1PTK2
SCHEMBL24565257 0.74 MAP4K1 (0.52) IGF1RMAPK8MAP4K1
SCHEMBL24565264 0.73 EGFR (0.56) —
SCHEMBL24565179 0.71 MAP4K1 (0.57) IGF1RMAPK8MAP4K1TTKGRK5

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-2022139386-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF 주식회사 비투에스바이오 2022-06-30 — — WO disclosed
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