SCHEMBL29324240

SCHEMBL29324240

COC(=O)CCC(=O)N1CCN(C(C)C)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.50
GLA P06280 1/20 0.49
ALDH1A1 P00352 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
KDM4E B2RXH2 2/20 0.46
TSHR P16473 2/20 0.45
EPHX1 P07099 2/20 0.42
EPHX2 P34913 2/20 0.42
LMNA P02545 2/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
NOTUM Q6P988 1/20 0.39
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP2D6 P10635 1/20 0.38

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
SCHEMBL12259096 0.82 GLA (0.54) GLAALDH1A1L3MBTL1KDM4ETSHR
SCHEMBL25872125 0.81 HRH3 (0.48) HRH3ALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL16133962 0.80 HRH3 (0.54) HRH3ALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL19754841 0.80 HRH3 (0.54) HRH3ALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL26700695 0.79 HRH3 (0.52) HRH3ALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL17576885 0.78 GLA (0.54) GLAALDH1A1L3MBTL1TSHREPHX1
SCHEMBL10130724 0.78 HRH3 (0.51) HRH3ALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL13043900 0.78 HRH3 (0.51) HRH3ALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL24731877 0.77 SMN1; SMN2 (0.53) ALDH1A1L3MBTL1KDM4ETSHRLMNA
SCHEMBL13043905 0.77 HRH3 (0.48) HRH3ALDH1A1L3MBTL1KDM4ELMNA

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
WO-2024149992-A1 IMAGING COMPOUNDS FOR DETECTING OR IMAGING SENESCENT CELLS UNIVERSITY OF DUNDEE (GB) 2024-07-18 WO disclosed