SCHEMBL4414748

SCHEMBL4414748

Cc1cc(=O)n(-c2ccccc2)[nH]1.O=C1N=NC=C1Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.44
MAPT P10636 6/20 0.44
KDM4E B2RXH2 6/20 0.44
KMT2A Q03164 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
GAA P10253 3/20 0.44
HTT P42858 3/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 3/20 0.42
RECQL P46063 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.40
TSHR P16473 1/20 0.40
POLB P06746 1/20 0.40
BLM P54132 1/20 0.40
ATM Q13315 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ALKBH3 Q96Q83 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
SCHEMBL9150171 0.77 ALDH1A1 (0.68) ALDH1A1MAPTKDM4EKMT2ASMN1; SMN2
SCHEMBL5425653 0.77 ALDH1A1 (0.68) ALDH1A1MAPTKDM4EKMT2ASMN1; SMN2
SCHEMBL196532 0.77 MAOA (0.44) KMT2AMEN1
SCHEMBL34121 0.77 ALDH1A1 (0.68) ALDH1A1MAPTKDM4EKMT2ASMN1; SMN2
Methyl Alcohol SCHEMBL1028813 0.74 MAPT (0.69) ALDH1A1MAPTKDM4EKMT2ASMN1; SMN2
SCHEMBL7164529 0.70 ALDH1A1 (0.58) ALDH1A1MAPTKDM4EKMT2ASMN1; SMN2
SCHEMBL5049514 0.70 MAPT (0.48) ALDH1A1MAPTKDM4EKMT2ASMN1; SMN2
SCHEMBL23907023 0.69 MAPT (0.65) ALDH1A1MAPTKDM4EKMT2ASMN1; SMN2
SCHEMBL5672410 0.69 ALDH1A1 (0.61) ALDH1A1MAPTKDM4EKMT2ASMN1; SMN2
SCHEMBL27895339 0.68 MAPT (0.51) ALDH1A1MAPTKDM4EKMT2ASMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2061421-A2 POLYMER THICKENED HAIR COLOURING AND BLEACHING COMPOSITIONS The Procter and Gamble Company (US) 2009-05-27 EP disclosed
WO-2008015646-A2 POLYMER THICKENED HAIR COLOURING AND BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2008-02-07 WO disclosed
EP-1669104-A2 Polymer thickened hair colouring and bleaching compositions The Procter and Gamble Company (US) 2006-06-14 EP disclosed
WO-2006060569-A2 POLYMER THICKENED HAIR COLOURING AND BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2006-06-08 WO disclosed