SCHEMBL9812554

SCHEMBL9812554

OCc1c(O)c(CO)c(Cl)c(CO)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.44
HPGD P15428 4/20 0.44
HSD17B10 Q99714 4/20 0.44
MEN1 O00255 2/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 1/20 0.44
PDXK O00764 1/20 0.38
DRD4 P21917 1/20 0.38
CYP1A2 P05177 4/20 0.35
HIF1A Q16665 3/20 0.35
CYP2C9 P11712 3/20 0.35
MAPK1 P28482 2/20 0.34
ERBB2 P04626 2/20 0.33
CYP2C19 P33261 2/20 0.33
PIM1 P11309 1/20 0.33
HKDC1 Q2TB90 1/20 0.33
NPC1 O15118 1/20 0.33
USP2 O75604 1/20 0.33

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
SCHEMBL9812437 0.90 TSHR (0.47) TSHRHPGDHSD17B10MEN1LMNA
SCHEMBL560496 0.87 MEN1 (0.33) TSHRHPGDHSD17B10MEN1LMNA
SCHEMBL10495966 0.84 HPGD (0.34) TSHRHPGDHSD17B10MEN1LMNA
SCHEMBL306109 0.83 MEN1 (0.35) TSHRHPGDHSD17B10MEN1LMNA
SCHEMBL9812427 0.81 TSHR (0.53) TSHRHPGDHSD17B10MEN1LMNA
SCHEMBL9812505 0.81 TSHR (0.53) TSHRHPGDHSD17B10MEN1LMNA
SCHEMBL522497 0.79 PDXK (0.33) PDXKDRD4
SCHEMBL11318159 0.76 MEN1 (0.35) TSHRHPGDHSD17B10MEN1LMNA
SCHEMBL3090283 0.75 ERBB2 (0.48) HPGDHSD17B10ALDH1A1PDXKDRD4
SCHEMBL28401227 0.75 DRD4 (0.47) HPGDHSD17B10ALDH1A1PDXKDRD4

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
EP-0234305-B1 METHOD FOR THE PRESERVATION OF WOOD Cooke, Theodore F. Jr. (US) 1991-07-03 EP claimed