SCHEMBL8922912

SCHEMBL8922912

CCN(CC)c1ccc2c(c1)C1(CCCOO1)NC2=N

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
HPGD P15428 2/20 0.34
MAPT P10636 2/20 0.34
HSD17B10 Q99714 2/20 0.34
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.32
GAA P10253 1/20 0.32
THRB P10828 1/20 0.32
ALOX15 P16050 1/20 0.32
CASP1 P29466 1/20 0.32
HTT P42858 1/20 0.32
CASP7 P55210 1/20 0.32

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
SCHEMBL8919838 0.91 ALDH1A1 (0.34) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL8918907 0.80
SCHEMBL8920555 0.79 PDK2 (0.34) ALDH1A1MEN1KMT2AHPGDHSD17B10
SCHEMBL8919892 0.78 PDE7A (0.35)
SCHEMBL8920301 0.77
SCHEMBL8918879 0.77 PDE7A (0.39) ALDH1A1MEN1KMT2AMAPTKDM4E
SCHEMBL8918980 0.75 DDB1 (0.30) DDB1CRBN
SCHEMBL8920321 0.75 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL8921504 0.75 PDK2 (0.40) ALDH1A1MEN1KMT2AMAPTL3MBTL1
SCHEMBL8918753 0.75 PDK2 (0.40) ALDH1A1MEN1KMT2AMAPTL3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691272-A Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, INC. (JP) 1997-11-25 US disclosed
US-5559247-A Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, INC. (JP) 1996-09-24 US disclosed
EP-0679640-A1 Carboxylate and heat-sensitive recording material using same MITSUI TOATSU CHEMICALS, Inc. (JP) 1995-11-02 EP disclosed