SCHEMBL14949883

SCHEMBL14949883

CCN(CCO)c1c[c]ccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 4/20 0.36
KMT2A Q03164 4/20 0.36
KDM4E B2RXH2 4/20 0.36
GAA P10253 4/20 0.36
MEN1 O00255 3/20 0.36
THRB P10828 1/20 0.36
RECQL P46063 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
PSMD14 O00487 1/20 0.35
MITF O75030 1/20 0.35
TSHR P16473 2/20 0.34
SLC29A1 Q99808 1/20 0.34
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
GHSR Q92847 1/20 0.32
HTT P42858 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL346581 0.89 MAPT (0.35) ALDH1A1MAPTKMT2AKDM4EGAA
SCHEMBL130243 0.85 ALDH1A1 (0.44) ALDH1A1CYP3A4MAPTKMT2AKDM4E
SCHEMBL3709630 0.83 TSHR (0.34) ALDH1A1CYP3A4KMT2AMEN1TSHR
SCHEMBL28860546 0.80 CNR2 (0.39) ALDH1A1KDM4ENPC1RAB9ATDP1
SCHEMBL27670512 0.79 DRD4 (0.36) ALDH1A1CYP3A4MAPTKMT2AGAA
SCHEMBL3039791 0.78 KMT2A (0.41) ALDH1A1CYP3A4MAPTKMT2AKDM4E
SCHEMBL131242 0.78 CNR2 (0.31) TSHRL3MBTL1
SCHEMBL133939 0.77 TSHR (0.55) ALDH1A1CYP3A4MAPTKMT2AKDM4E
SCHEMBL27948257 0.77 CNR2 (0.31)
SCHEMBL9458404 0.76 TSHR (0.34) ALDH1A1CYP3A4TSHRNR1H2NR1H3

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
US-8444716-B1 Soluble solid hair coloring article THE PROCTER & GAMBLE COMPANY (US) 2013-05-21 US disclosed