SCHEMBL20024345

SCHEMBL20024345

CCCCC(CC)COc1ccc(-c2nc(-c3ccccc3C)nc(-c3ccccc3C)n2)c(O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.41
ALDH1A1 P00352 6/20 0.39
CA2 P00918 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 5/20 0.39
HTT P42858 2/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
TSHR P16473 3/20 0.37
HPGD P15428 2/20 0.37
POLB P06746 2/20 0.37
MAPK1 P28482 5/20 0.36
NPC1 O15118 4/20 0.36
TP53 P04637 2/20 0.36
GAA P10253 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CNR1 P21554 1/20 0.36

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
SCHEMBL7217044 0.91 LMNA (0.42) LMNAALDH1A1CA2CYP3A4MAPT
SCHEMBL7894750 0.89 LMNA (0.37) LMNAALDH1A1CA2CYP3A4MAPT
SCHEMBL20024340 0.89 LMNA (0.37) LMNAALDH1A1CA2CYP3A4MAPT
SCHEMBL8866441 0.89 LMNA (0.41) LMNAALDH1A1CA2CYP3A4MAPT
SCHEMBL6031655 0.88 LMNA (0.41) LMNAALDH1A1CA2CYP3A4MAPT
SCHEMBL27861746 0.88 LMNA (0.42) LMNAALDH1A1CA2CYP3A4MAPT
SCHEMBL1290508 0.88 LMNA (0.42) LMNAALDH1A1CA2CYP3A4MAPT
SCHEMBL29120353 0.88 LMNA (0.42) LMNAALDH1A1CA2CYP3A4MAPT
SCHEMBL28638598 0.88 LMNA (0.40) LMNAALDH1A1CA2CYP3A4MAPT
SCHEMBL7021073 0.87 MEN1 (0.45) LMNAALDH1A1CA2CYP3A4MAPT

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-20180095374-A1 MIXTURE, TONER, AND DISPERSION CANON KABUSHIKI KAISHA (JP) 2018-04-05 US disclosed
US-20180095374-A1 MIXTURE, TONER, AND DISPERSION CANON KABUSHIKI KAISHA (JP) 2018-04-05 US disclosed