SCHEMBL29159204

SCHEMBL29159204

COc1ccc(OC)c(NC(=O)Nc2cc(NNCc3ccc(N4CCCCC4)cc3)ncn2)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FGFR3 P22607 3/20 0.51
▸ EGFR P00533 3/20 0.48
▸ ERBB3 P21860 1/20 0.48
▸ FGFR1 P11362 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ MAPT P10636 5/20 0.45
▸ POLB P06746 2/20 0.45
▸ LMNA P02545 1/20 0.45
▸ GAA P10253 1/20 0.44
▸ GFER P55789 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ CHEK1 O14757 1/20 0.42

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
SCHEMBL28498241 0.85 FGFR3 (0.69) FGFR3EGFRERBB3FGFR1MAPT
SCHEMBL374616 0.77 FGFR3 (0.82) FGFR3EGFRERBB3FGFR1
SCHEMBL28497440 0.72 EGFR (0.60) FGFR3EGFRERBB3FGFR1L3MBTL1
SCHEMBL374803 0.72 FGFR3 (0.69) FGFR3EGFRERBB3FGFR1GFER
SCHEMBL28498357 0.71 EGFR (0.66) FGFR3EGFRERBB3FGFR1MAPT
SCHEMBL374531 0.70 FGFR3 (0.79) FGFR3EGFRERBB3FGFR1MAPT
SCHEMBL374370 0.69 FGFR3 (0.82) FGFR3EGFRERBB3
SCHEMBL374127 0.68 FGFR3 (0.75) FGFR3EGFRERBB3MAPTPOLB
SCHEMBL374587 0.68 FGFR3 (1.00) FGFR3EGFRERBB3FGFR1
SCHEMBL19427718 0.68 MAPT (0.79) L3MBTL1MAPTPOLBGAASMN1; SMN2

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
CN-110283130-B 1- (2, 5-dimethoxy phenyl) -3-substituted urea colon cancer inhibitor and preparation and application thereof 温州医科大学 2023-12-19 — — CN disclosed
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