SCHEMBL10581062

SCHEMBL10581062

Nc1ccc(N)c2c1C(=O)c1cccc(NCCO)c1C2=O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NSD2 O96028 3/20 0.63
▸ MMP14 P50281 2/20 0.63
▸ FGB P02675 1/20 0.63
▸ MEN1 O00255 7/20 0.54
▸ KMT2A Q03164 7/20 0.54
▸ BLM P54132 5/20 0.54
▸ POLB P06746 5/20 0.54
▸ SMN1; SMN2 Q16637 5/20 0.54
▸ MAPK1 P28482 4/20 0.54
▸ MAPT P10636 4/20 0.54
▸ L3MBTL1 Q9Y468 4/20 0.54
▸ EGFR P00533 3/20 0.54
▸ HTT P42858 3/20 0.54
▸ LMNA P02545 3/20 0.54
▸ RECQL P46063 3/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ NPSR1 Q6W5P4 2/20 0.54
▸ RAD52 P43351 1/20 0.54
▸ TOP2B Q02880 1/20 0.51
▸ TERT O14746 1/20 0.49

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
SCHEMBL20333922 0.90 NSD2 (0.82) NSD2MMP14FGBMEN1KMT2A
SCHEMBL9357997 0.89 NSD2 (0.77) NSD2MMP14FGBMEN1KMT2A
SCHEMBL20333890 0.88 NSD2 (0.69) NSD2MMP14FGBMEN1KMT2A
SCHEMBL20334294 0.87 NSD2 (0.52) NSD2MMP14FGBMEN1KMT2A
SCHEMBL595621 0.87 TOP2B (0.68) NSD2MMP14FGBMEN1KMT2A
SCHEMBL4732627 0.84 MEN1 (0.72) NSD2MMP14FGBMEN1KMT2A
SCHEMBL7829735 0.84 NSD2 (0.55) NSD2MMP14FGBMEN1KMT2A
SCHEMBL3917115 0.84 NSD2 (0.65) NSD2MMP14FGBMEN1KMT2A
SCHEMBL20333884 0.83 FGB (0.53) NSD2MMP14FGBMEN1KMT2A
SCHEMBL23787848 0.83 NSD2 (0.70) NSD2MMP14FGBMEN1KMT2A

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
US-4886517-A GOOD WATER SOLUBILITY L'OREAL (FR) 1989-12-12 — — US disclosed
Send feedback