SCHEMBL11511564

SCHEMBL11511564

CCOC(C)c1ccc(N)cc1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.40
KMT2A Q03164 7/20 0.40
MAPT P10636 5/20 0.40
ALDH1A1 P00352 5/20 0.40
GAA P10253 4/20 0.40
KDM4E B2RXH2 4/20 0.40
TDP1 Q9NUW8 3/20 0.40
CASP1 P29466 3/20 0.40
TP53 P04637 2/20 0.40
POLB P06746 2/20 0.40
HTT P42858 2/20 0.40
CASP7 P55210 2/20 0.40
USP2 O75604 2/20 0.40
ATM Q13315 1/20 0.40
TSHR P16473 2/20 0.39
CYP3A4 P08684 1/20 0.39
MAPK1 P28482 3/20 0.35
HSD17B10 Q99714 3/20 0.35
HPGD P15428 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL11513412 0.86 GAA (0.49) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL6816261 0.85 MAPT (0.40) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL22897592 0.84 TDP1 (0.42) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL11511512 0.83 ALDH1A1 (0.42) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL11511247 0.80 MEN1 (0.39) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL11512649 0.79 CASP1 (0.41) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL11517452 0.77 MEN1 (0.40) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL28098361 0.77 MEN1 (0.37) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL10696326 0.77 ALDH1A1 (0.48) MEN1KMT2AMAPTALDH1A1KDM4E
Hydrochloric Acid SCHEMBL28297677 0.76 MEN1 (0.39) MEN1KMT2AMAPTALDH1A1GAA

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-4171203-A IN COMBINATION WITH A TETRAAMINOPYRIMIDING COUPLER SURFACTANTS AND THICKENERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1979-10-16 US disclosed