SCHEMBL7572149

SCHEMBL7572149

[O]CC(O)CN1CCCCCC1

nearest known ligand 0.73

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.73
KMT2A Q03164 3/20 0.73
ATM Q13315 2/20 0.60
MAPT P10636 1/20 0.60
HSD17B10 Q99714 2/20 0.59
CYP2D6 P10635 2/20 0.47
CYP2C19 P33261 1/20 0.47
ANPEP P15144 1/20 0.45
ERAP2 Q6P179 1/20 0.45
POLB P06746 2/20 0.44
TSHR P16473 1/20 0.44
HIF1A Q16665 1/20 0.44
KDM4E B2RXH2 4/20 0.44
GLA P06280 1/20 0.44
ACE2 Q9BYF1 1/20 0.43
ALDH1A1 P00352 1/20 0.43
USP2 O75604 1/20 0.43
PKM P14618 1/20 0.42

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
SCHEMBL4378009 1.00 MEN1 (0.73) MEN1KMT2AATMMAPTHSD17B10
SCHEMBL5218126 1.00 MEN1 (0.73) MEN1KMT2AATMMAPTHSD17B10
SCHEMBL2434746 1.00 MEN1 (0.73) MEN1KMT2AATMMAPTHSD17B10
SCHEMBL4376156 1.00 MEN1 (0.73) MEN1KMT2AATMMAPTHSD17B10
SCHEMBL10476 0.98 MEN1 (0.68) MEN1KMT2AATMMAPTHSD17B10
SCHEMBL4381893 0.98 MEN1 (0.68) MEN1KMT2AATMMAPTHSD17B10
SCHEMBL4382056 0.98 MEN1 (0.68) MEN1KMT2AATMMAPTHSD17B10
SCHEMBL7571912 0.93
SCHEMBL11118757 0.85 MEN1 (1.00) MEN1KMT2AATMMAPTHSD17B10
SCHEMBL10895166 0.82 MEN1 (0.94) MEN1KMT2AATMMAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002092578-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-11-21 WO claimed
WO-2002092577-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-11-21 WO claimed
WO-2002092578-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-11-21 WO disclosed
WO-2002092577-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-11-21 WO disclosed