SCHEMBL29324242

SCHEMBL29324242

CNCCCCNC(=O)CCC(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
RECQL P46063 1/20 0.47
CASP2 P42575 1/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NAAA Q02083 1/20 0.43
EPHX2 P34913 4/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL22134543 0.85 NAAA (0.52) TSHRRECQLCASP2MEN1KMT2A
SCHEMBL860790 0.85 KDM4E (0.56) TSHRRECQLCASP2MEN1KMT2A
SCHEMBL13129293 0.83 CASP2 (0.69) CASP2NAAAEPHX2POLBL3MBTL1
SCHEMBL4093621 0.83 CASP2 (0.69) CASP2NAAAEPHX2POLBL3MBTL1
SCHEMBL10728553 0.82 CASP2 (0.57) TSHRRECQLCASP2NAAAEPHX2
SCHEMBL15399777 0.82 TSHR (0.65) TSHRRECQLCASP2MEN1KMT2A
SCHEMBL2771342 0.82 RECQL (0.63) TSHRRECQLCASP2MEN1KMT2A
SCHEMBL21782549 0.81 RECQL (0.48) TSHRRECQLCASP2MEN1KMT2A
SCHEMBL694512 0.81 TSHR (0.64) TSHRRECQLMEN1KMT2AEPHX2
SCHEMBL13376980 0.80 RECQL (0.61) TSHRRECQLCASP2NAAAEPHX2

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