SCHEMBL29621097

SCHEMBL29621097

N#Cc1ccc(Nc2ncc(-c3ccc(C4CC4)cn3)o2)cn1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 3/20 0.38
▸ CHEK1 O14757 12/20 0.38
▸ JAK2 O60674 1/20 0.37
▸ JAK1 P23458 1/20 0.37
▸ FLT1 P17948 3/20 0.35
▸ FLT4 P35916 3/20 0.35
▸ KDR P35968 3/20 0.35
▸ IMPDH2 P12268 1/20 0.35

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
SCHEMBL22925545 1.00 DGAT1 (0.38) DGAT1CHEK1JAK2JAK1FLT1
SCHEMBL29620981 0.86 FLT1 (0.44) DGAT1CHEK1FLT1FLT4KDR
SCHEMBL22925978 0.86 FLT1 (0.44) DGAT1CHEK1FLT1FLT4KDR
SCHEMBL22925742 0.82 CHEK1 (0.40) CHEK1FLT1FLT4KDRIMPDH2
SCHEMBL29620891 0.82 CHEK1 (0.40) CHEK1FLT1FLT4KDRIMPDH2
SCHEMBL22925918 0.81 VCP (0.44) CHEK1FLT1FLT4KDRIMPDH2
SCHEMBL22925932 0.79 CHEK1 (0.39) CHEK1FLT1FLT4KDRIMPDH2
SCHEMBL29620907 0.78 MEN1 (0.40) CHEK1FLT1FLT4KDRIMPDH2
SCHEMBL28733613 0.78 MEN1 (0.40) CHEK1FLT1FLT4KDRIMPDH2
SCHEMBL22925546 0.77 DGAT1 (0.38) DGAT1FLT1FLT4KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114450281-B Inhibitor compounds 辛塞拉治疗私人有限公司 2024-08-16 — — CN disclosed
EP-4003986-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2022-06-01 — — EP disclosed
CN-114450281-A Inhibitor compounds 辛塞拉治疗私人有限公司 2022-05-06 — — CN disclosed
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