SCHEMBL22925705

SCHEMBL22925705

COc1ccc(COc2cc(Nc3ncc(-c4ccc(C(F)(F)F)cc4)o3)ncc2OC)cc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FLT1 P17948 6/20 0.46
▸ FLT4 P35916 6/20 0.46
▸ KDR P35968 6/20 0.46
▸ IMPDH2 P12268 1/20 0.44
▸ TRPV1 Q8NER1 6/20 0.42
▸ GSK3B P49841 1/20 0.41
▸ KIT P10721 2/20 0.41
▸ CLK1 P49759 1/20 0.40
▸ DYRK1A Q13627 1/20 0.40
▸ CSF1R P07333 1/20 0.38

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
SCHEMBL22925873 0.89 IMPDH2 (0.45) FLT1FLT4KDRIMPDH2TRPV1
SCHEMBL29696276 0.86 TRPV1 (0.42) FLT1FLT4KDRIMPDH2TRPV1
SCHEMBL31755987 0.85 TRPV1 (0.39) FLT1FLT4KDRIMPDH2TRPV1
SCHEMBL22926054 0.84 GSK3B (0.41) FLT1FLT4KDRIMPDH2TRPV1
SCHEMBL29621081 0.84 GSK3B (0.41) FLT1FLT4KDRIMPDH2TRPV1
SCHEMBL28733676 0.82 TRPV1 (0.41) FLT1FLT4KDRIMPDH2TRPV1
SCHEMBL22926050 0.82 NPSR1 (0.39) FLT1FLT4KDRIMPDH2TRPV1
SCHEMBL29620970 0.82 NPSR1 (0.39) FLT1FLT4KDRIMPDH2TRPV1
SCHEMBL28733678 0.82 NPSR1 (0.39) FLT1FLT4KDRIMPDH2TRPV1
SCHEMBL22925774 0.80 TRPV1 (0.48) FLT1FLT4KDRIMPDH2TRPV1

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 4 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
WO-2021012018-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2021-01-28 — — WO disclosed
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