SCHEMBL29620924

SCHEMBL29620924

N#Cc1ccc(Nc2ncc(-c3ccc(Cl)cc3)o2)cn1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ VCP P55072 5/20 0.62
▸ SIRT7 Q9NRC8 1/20 0.54
▸ KDR P35968 6/20 0.47
▸ FLT1 P17948 5/20 0.47
▸ FLT4 P35916 5/20 0.47
▸ IMPDH2 P12268 4/20 0.46
▸ GSK3B P49841 1/20 0.45
▸ CHEK1 O14757 1/20 0.44
▸ ALOX5 P09917 1/20 0.43

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
SCHEMBL22925926 1.00 VCP (0.62) VCPSIRT7KDRFLT1FLT4
SCHEMBL22925918 0.85 VCP (0.44) VCPSIRT7KDRFLT1FLT4
SCHEMBL22925496 0.84 TRPV1 (0.47) VCPKDRFLT1FLT4IMPDH2
SCHEMBL29620900 0.84 KDR (0.45) VCPSIRT7KDRFLT1FLT4
SCHEMBL28733673 0.84 KDR (0.45) VCPSIRT7KDRFLT1FLT4
SCHEMBL29620967 0.84 TRPV1 (0.47) VCPKDRFLT1FLT4IMPDH2
SCHEMBL24636886 0.83 VCP (0.53) VCPSIRT7KDRFLT1FLT4
SCHEMBL29621095 0.83 VCP (0.53) VCPSIRT7KDRFLT1FLT4
SCHEMBL22925978 0.83 FLT1 (0.44) VCPSIRT7KDRFLT1FLT4
SCHEMBL29620981 0.83 FLT1 (0.44) VCPSIRT7KDRFLT1FLT4

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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