SCHEMBL29174191

SCHEMBL29174191

CC(=O)OCC(=O)Nc1c(I)cc(I)c(C(=O)Cl)c1I

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
HPGD P15428 2/20 0.43
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 6/20 0.40
ALDH1A1 P00352 2/20 0.40
PKM P14618 1/20 0.39
HSD17B10 Q99714 1/20 0.37
MAPT P10636 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
KDM4E B2RXH2 1/20 0.34
RXFP1 Q9HBX9 1/20 0.33
POLB P06746 1/20 0.32

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
SCHEMBL30807536 1.00 TSHR (0.48) TSHRMAPK1HPGDUSP2SMN1; SMN2
SCHEMBL708587 0.84 ALDH1A1 (0.42) HPGDUSP2SMN1; SMN2ALDH1A1PKM
SCHEMBL23817039 0.80 LMNA (0.42) TSHRMAPK1HPGDUSP2SMN1; SMN2
SCHEMBL22661239 0.80 SMN1; SMN2 (0.40) HPGDUSP2SMN1; SMN2ALDH1A1PKM
SCHEMBL8906827 0.80 ALDH1A1 (0.38) HPGDUSP2SMN1; SMN2ALDH1A1PKM
SCHEMBL9001937 0.79 MAPK1 (0.46) TSHRMAPK1HPGDSMN1; SMN2ALDH1A1
SCHEMBL9196383 0.77 LMNA (0.38) HPGDUSP2SMN1; SMN2ALDH1A1PKM
SCHEMBL7528241 0.76 PKM (0.43) HPGDUSP2SMN1; SMN2ALDH1A1PKM
SCHEMBL8342120 0.74 LMNA (0.47) TSHRMAPK1HPGDUSP2SMN1; SMN2
SCHEMBL22645203 0.74 LMNA (0.47) TSHRMAPK1HPGDUSP2SMN1; SMN2

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-117700333-A Preparation method of iomeprol impurity 兄弟科技股份有限公司 2024-03-15 CN disclosed