SCHEMBL10476376

SCHEMBL10476376

N#CC(=Cc1ccc(O)c2ccccc12)c1nc2ccccc2[nH]1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 10/20 0.67
▸ KMT2A Q03164 10/20 0.67
▸ NSD2 O96028 1/20 0.67
▸ BLM P54132 1/20 0.67
▸ MAPT P10636 9/20 0.60
▸ KDM4E B2RXH2 4/20 0.60
▸ NPC1 O15118 6/20 0.59
▸ RAB9A P51151 6/20 0.59
▸ POLB P06746 6/20 0.59
▸ USP2 O75604 2/20 0.59
▸ NPSR1 Q6W5P4 3/20 0.59
▸ ALDH1A1 P00352 2/20 0.59
▸ THRB P10828 1/20 0.59
▸ CDC7 O00311 1/20 0.59
▸ PLK4 O00444 1/20 0.59
▸ CHEK1 O14757 1/20 0.59
▸ PDPK1 O15530 1/20 0.59
▸ DAPK3 O43293 1/20 0.59
▸ DYRK3 O43781 1/20 0.59
▸ PRKD3 O94806 1/20 0.59

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
SCHEMBL5594463 0.82 MEN1 (0.67) MEN1KMT2ANSD2BLMMAPT
SCHEMBL5594404 0.82 APP (0.64) MEN1KMT2ANSD2BLMMAPT
SCHEMBL12881142 0.80 MEN1 (1.00) MEN1KMT2ANSD2BLMMAPT
SCHEMBL5594708 0.80 MEN1 (1.00) MEN1KMT2ANSD2BLMMAPT
SCHEMBL27983608 0.79 MAPT (0.82) MEN1KMT2ANSD2BLMMAPT
SCHEMBL10476384 0.78 THRB (0.79) MEN1KMT2ANSD2BLMMAPT
SCHEMBL21578429 0.78 MAPT (0.64) MEN1KMT2ANSD2BLMMAPT
SCHEMBL12351215 0.77 MAPT (0.65) MEN1KMT2ANSD2BLMMAPT
SCHEMBL5594436 0.75 MAPT (0.72) MEN1KMT2ANSD2BLMMAPT
SCHEMBL10476361 0.75 MAPT (0.75) MEN1KMT2ANSD2BLMMAPT

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
EP-1778176-B1 COMPOSITION FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO KGAA (DE) 2012-07-25 — — EP disclosed
Send feedback