SCHEMBL8748534

SCHEMBL8748534

COc1cc(NCc2ccc(C)o2)cc(OC)c1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.51
MEN1 O00255 2/20 0.48
ALDH1A1 P00352 2/20 0.48
MAPT P10636 2/20 0.48
KMT2A Q03164 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
KDM4E B2RXH2 1/20 0.48
NPC1 O15118 1/20 0.48
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
HTT P42858 1/20 0.48
GFER P55789 1/20 0.48
TUBB4A P04350 3/20 0.47
TUBB P07437 3/20 0.47
TUBA3C P0DPH7 3/20 0.47
TUBA1B P68363 3/20 0.47
TUBA4A P68366 3/20 0.47
TUBB4B P68371 3/20 0.47

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
SCHEMBL8748288 0.85 MAPT (0.55) MAPK1MEN1ALDH1A1MAPTKMT2A
SCHEMBL20871931 0.76 TUBB4A (0.47) MAPK1MEN1ALDH1A1MAPTKMT2A
SCHEMBL8748446 0.76 MAPT (0.52) MAPK1MEN1ALDH1A1MAPTKMT2A
SCHEMBL12963511 0.73 TUBB4A (0.47) MAPK1MEN1ALDH1A1MAPTKMT2A
SCHEMBL8635317 0.73 PDGFRB (0.42) MAPK1ALDH1A1KDM4ELMNATSHR
SCHEMBL8748209 0.72 CHRM2 (0.49) MAPK1MEN1ALDH1A1MAPTKMT2A
SCHEMBL30844035 0.72 NPC1 (0.51) MEN1ALDH1A1MAPTKMT2AKDM4E
SCHEMBL5841682 0.71 TUBB4A (0.59) MAPK1MEN1ALDH1A1MAPTKMT2A
SCHEMBL9190510 0.70 TUBB4A (0.77) MAPK1MEN1ALDH1A1MAPTKMT2A
SCHEMBL12963403 0.70 TUBB1 (0.58) MAPK1MEN1ALDH1A1MAPTKMT2A

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
EP-0761214-A2 N,N-disubstituted anilines or alkylamines as singlet oxygen quenchers, topical compositions comprising them KAO CORPORATION (JP) 1997-03-12 EP disclosed