SCHEMBL8039657

SCHEMBL8039657

CCN(CC)c1ccc(N(CC)CCO)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.54
L3MBTL1 Q9Y468 3/20 0.54
PSMD14 O00487 2/20 0.54
TSHR P16473 2/20 0.54
MAPK1 P28482 2/20 0.54
RECQL P46063 2/20 0.54
CYP3A4 P08684 2/20 0.54
GFER P55789 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ALDH3A1 P30838 1/20 0.50
ALDH1A3 P47895 1/20 0.50
KMT2A Q03164 6/20 0.49
MAPT P10636 6/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
MITF O75030 1/20 0.49
GAA P10253 4/20 0.48
KDM4E B2RXH2 3/20 0.48
MEN1 O00255 5/20 0.46
HPGD P15428 2/20 0.46

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
Hydrochloric Acid SCHEMBL8042521 0.98 ALDH1A1 (0.52) ALDH1A1L3MBTL1PSMD14TSHRMAPK1
SCHEMBL8038944 0.98 ALDH1A1 (0.50) ALDH1A1L3MBTL1PSMD14TSHRMAPK1
SCHEMBL10485747 0.95 ALDH1A1 (0.54) ALDH1A1L3MBTL1PSMD14TSHRMAPK1
Hydrochloric Acid SCHEMBL8040784 0.95 KMT2A (0.49) ALDH1A1L3MBTL1PSMD14TSHRMAPK1
SCHEMBL7153625 0.94 ALDH1A1 (0.48) ALDH1A1L3MBTL1PSMD14TSHRMAPK1
Hydrochloric Acid SCHEMBL8039735 0.93 ALDH1A1 (0.52) ALDH1A1L3MBTL1PSMD14TSHRMAPK1
SCHEMBL14304360 0.90 AOC3 (0.53) ALDH1A1L3MBTL1PSMD14TSHRMAPK1
SCHEMBL2765786 0.89 MAPT (0.49) ALDH1A1L3MBTL1PSMD14TSHRMAPK1
SCHEMBL10607435 0.87 KMT2A (0.44) ALDH1A1L3MBTL1PSMD14TSHRMAPK1
SCHEMBL8686227 0.87 ALDH1A1 (0.46) ALDH1A1L3MBTL1PSMD14TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0663446-B1 Electrochemical assay method and novel p-phenylenediamine compound MOCHIDA PHARM CO LTD (JP) 2000-03-22 EP disclosed
US-5609749-A FUNCTIONS AS ELECTRON MEDIATOR, MODULATION OF OXIDATION-REDUCTION ENZYME ACTIVITY IS MEASURED, IMMUNOASSAY MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1997-03-11 US disclosed
EP-0663446-A2 Electrochemical assay method and novel p-phenylenediamine compound MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1995-07-19 EP disclosed