SCHEMBL6972943

SCHEMBL6972943

CCOC(=O)C1CCN(c2cc(C)nc(C)n2)CC1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
KMT2A Q03164 4/20 0.58
MEN1 O00255 3/20 0.58
KDM4E B2RXH2 3/20 0.58
LMNA P02545 1/20 0.58
SHMT2 P34897 1/20 0.55
MAPT P10636 4/20 0.51
LGMN Q99538 1/20 0.50
HPGD P15428 2/20 0.49
HSD17B10 Q99714 2/20 0.49
MAPK1 P28482 3/20 0.48
NPSR1 Q6W5P4 2/20 0.48
GLA P06280 1/20 0.48
RAB9A P51151 1/20 0.48
POLB P06746 1/20 0.48
TSHR P16473 1/20 0.47
TDP1 Q9NUW8 1/20 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
SCHEMBL3247929 0.87 SHMT2 (0.59) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL10169430 0.81 TDP1 (0.67) ALDH1A1KMT2AKDM4ELMNAMAPT
SCHEMBL16648648 0.80 GAA (0.53) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL16648608 0.79 MAPT (0.57) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL9413151 0.78 MEN1 (0.56) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL793103 0.78 HPGD (0.53) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL16695436 0.77 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL868893 0.77 ALDH1A1 (0.60) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL25250089 0.75 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1KDM4ELMNA
SCHEMBL15578245 0.75 MAPT (0.56) ALDH1A1KMT2AMEN1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0925286-B1 SUBSTITUTED PYRIMIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ASTRAZENECA AB (SE) 2003-01-02 EP disclosed
US-6093718-A AN OXIDO-SQUALENE CYCLASE INHIBITOR, ANTICHOLESTEROL AGENT FOR INHIBITING CHOLESTEROL BIOSYNTHESIS AND LOWERING CHOLESTEROL LEVELS IN BLOOD PLASMA; TREATING HYPERCHOLESTEROLEMIA AND ATHEROSCLEROSIS ZENECA LIMITED (GB) 2000-07-25 US disclosed
CN-1228087-A Substituted pyrimidine derivatives and their pharmaceutical use ZENECA LTD (GB) 1999-09-08 CN disclosed
EP-0925286-A1 SUBSTITUTED PYRIMIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ZENECA LIMITED (GB) 1999-06-30 EP disclosed
WO-1998006705-A1 SUBSTITUTED PYRIMIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ZENECA LIMITED (GB) 1998-02-19 WO disclosed