SCHEMBL7976542

SCHEMBL7976542

CCN(CC)c1ccc(C=[N+]([O-])c2ccc(C#N)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.44
MAPT P10636 10/20 0.44
MEN1 O00255 9/20 0.44
KMT2A Q03164 9/20 0.44
LMNA P02545 5/20 0.44
ALDH3A1 P30838 1/20 0.42
ALDH1A3 P47895 1/20 0.42
FBP1 P09467 2/20 0.41
GAA P10253 4/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HBB P68871 1/20 0.41
KDM4E B2RXH2 3/20 0.41
USP2 O75604 2/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 4/20 0.40
L3MBTL1 Q9Y468 4/20 0.40
TDP1 Q9NUW8 2/20 0.40

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
SCHEMBL506738 0.84 FBP1 (0.44) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL505897 0.81 ALDH1A1 (0.58) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL506334 0.81 ALDH1A1 (0.56) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL21594513 0.79 ALDH1A1 (0.53) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL21594521 0.79 ALDH1A1 (0.53) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL63804 0.78 ALDH1A1 (0.52) ALDH1A1MAPTMEN1KMT2AALDH3A1
SCHEMBL27958255 0.78 MAPT (0.46) ALDH1A1MAPTLMNAFBP1GAA
SCHEMBL9315237 0.77 ALDH1A1 (0.51) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL506330 0.77 MAPT (0.52) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL8039810 0.76 CA12 (0.53) ALDH1A1MAPTMEN1KMT2AFBP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6277545-B1 FORMING PHOTORESIST, IRADIATING WITH LASER PIONEER ELECTRONIC CORPORATION (JP) 2001-08-21 US disclosed
EP-0555583-A1 Method for manufacturing optical discs PIONEER ELECTRONIC CORPORATION (JP) 1993-08-18 EP disclosed