SCHEMBL28857052

SCHEMBL28857052

NC(=O)OC1CCCN(C(=O)CCl)CC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
LMNA P02545 1/20 0.47
TPSAB1 Q15661 12/20 0.43
TPSD1 Q9BZJ3 12/20 0.43
TPSG1 Q9NRR2 12/20 0.43
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HDAC2 Q92769 1/20 0.39
PRSS1 P07477 3/20 0.37
F2 P00734 2/20 0.37
YAP1 P46937 1/20 0.37
TEAD4 Q15561 1/20 0.37
PLG P00747 1/20 0.36
KMT2A Q03164 1/20 0.34

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
SCHEMBL29179866 0.94 ALDH1A1 (0.55) ALDH1A1LMNATPSAB1TPSD1TPSG1
SCHEMBL28857047 0.83 ALDH1A1 (0.50) ALDH1A1LMNATPSAB1TPSD1TPSG1
SCHEMBL29013169 0.81 TPSAB1 (0.43) ALDH1A1TPSAB1TPSD1TPSG1SMN1; SMN2
SCHEMBL29144075 0.78 TPSAB1 (0.44) ALDH1A1TPSAB1TPSD1TPSG1SMN1; SMN2
SCHEMBL28425908 0.77 EPHX2 (0.45) ALDH1A1TPSAB1TPSD1TPSG1
Hydrochloric Acid SCHEMBL9833904 0.76 TPSAB1 (0.38) ALDH1A1LMNATPSAB1TPSD1TPSG1
SCHEMBL29260222 0.76 TPSAB1 (0.44) ALDH1A1TPSAB1TPSD1TPSG1POLB
Hydrochloric Acid SCHEMBL9836812 0.75 ALDH1A1 (0.38) ALDH1A1LMNATPSAB1TPSD1TPSG1
SCHEMBL29144108 0.74 KMT2A (0.50) ALDH1A1TPSAB1TPSD1TPSG1POLB
SCHEMBL27668592 0.74 TPSAB1 (0.42) ALDH1A1LMNATPSAB1TPSD1TPSG1

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
CN-115151561-A Targeted autophagy conjugates and methods 前沿药品公司 2022-10-04 CN disclosed