SCHEMBL10366559

SCHEMBL10366559

Nc1ccc2c(c1)C1=NN(c3ccccc3)C(=O)CC1CC2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
GAA P10253 2/20 0.43
RECQL P46063 2/20 0.43
NPC1 O15118 1/20 0.43
GLA P06280 1/20 0.43
MAPK1 P28482 1/20 0.43
CASP3 P42574 1/20 0.43
RAB9A P51151 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
ACHE P22303 5/20 0.37
BCHE P06276 4/20 0.37

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
SCHEMBL10660494 0.89 KDM4E (0.34) KDM4EALDH1A1MAPTGAARECQL
SCHEMBL10367572 0.87 KDM4E (0.44) KDM4EALDH1A1MAPTGAARECQL
SCHEMBL7287680 0.86 ALDH1A1 (0.43) KDM4EALDH1A1MAPTGAARECQL
SCHEMBL10366385 0.86 KDM4E (0.43) KDM4EALDH1A1MAPTGAARECQL
SCHEMBL10366230 0.84 ALDH1A1 (0.37) KDM4EALDH1A1MAPTGAARECQL
SCHEMBL10373828 0.83 KDM4E (0.41) KDM4EALDH1A1MAPTGAARECQL
SCHEMBL10368645 0.83 GAA (0.41) KDM4EALDH1A1MAPTGAARECQL
SCHEMBL10366069 0.82 MAPT (0.43) KDM4EALDH1A1MAPTGAARECQL
SCHEMBL7290530 0.81 PDE4A (0.38) KDM4EALDH1A1MAPTGAARECQL
SCHEMBL10665164 0.81 MEN1 (0.46) KDM4EALDH1A1MAPTGAARECQL

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-0190367-B1 BENZO ADH BDCINNOLINE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND MECIDINAL COMPOSITION CONTAINING THEM Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1990-01-17 EP disclosed
US-4782057-A ANTIDOTES FOR OVERSEDATION, ANXIOLYTICS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1988-11-01 US disclosed
EP-0190367-A1 BENZO ADh BDCINNOLINE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND MECIDINAL COMPOSITION CONTAINING THEM Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1986-08-13 EP disclosed