SCHEMBL7034149

SCHEMBL7034149

CCc1cc(CC)c(C#N)c(CC)c1C#N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.37
KDM4E B2RXH2 10/20 0.37
HPGD P15428 8/20 0.37
MAPT P10636 6/20 0.37
GAA P10253 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
GLA P06280 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 6/20 0.37
LMNA P02545 1/20 0.37
ALOX15 P16050 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
USP2 O75604 2/20 0.35
CYP1A2 P05177 2/20 0.34
KDM5A P29375 2/20 0.34
FPR1 P21462 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL20334763 0.91 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDMAPTGAA
SCHEMBL23529430 0.86 KDM4E (0.39) ALDH1A1KDM4EHPGDMAPTGAA
SCHEMBL1924277 0.85 KDM4E (0.33) ALDH1A1KDM4EHPGDMAPTGAA
SCHEMBL9292632 0.81 KDM4E (0.40) ALDH1A1KDM4EHPGDMAPTGAA
SCHEMBL12566682 0.79 ALDH1A1 (0.45) ALDH1A1KDM4EHPGDMAPTGAA
SCHEMBL8149466 0.79 ALDH1A1 (0.45) ALDH1A1KDM4EHPGDMAPTGAA
SCHEMBL2154515 0.76 CYP2A6 (0.43) ALDH1A1KDM4EHPGDMAPTGAA
SCHEMBL16883661 0.76 KDM4E (0.41) ALDH1A1KDM4EHPGDMAPTGAA
SCHEMBL28068652 0.76 CYP2A6 (0.43) ALDH1A1KDM4EHPGDMAPTGAA
SCHEMBL29038305 0.74 KDM5A (0.34) ALDH1A1KDM4EHPGDMAPTGAA

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-1325065-A2 COMPOSITION FOR PREPARING A LATEX FOAM DOW GLOBAL TECHNOLOGIES INC. (US) 2003-07-09 EP disclosed
WO-2002026873-B1 COMPOSITION FOR PREPARING A LATEX FOAM DOW GLOBAL TECHNOLOGIES INC (US) 2003-03-06 WO disclosed
WO-2002026873-A3 COMPOSITION FOR PREPARING A LATEX FOAM DOW GLOBAL TECHNOLOGIES INC (US) 2003-01-16 WO disclosed
WO-2002026873-A2 COMPOSITION FOR PREPARING A LATEX FOAM DOW GLOBAL TECHNOLOGIES INC (US) 2002-04-04 WO disclosed