SCHEMBL8942210

SCHEMBL8942210

COc1cccc(OP(=O)(Cl)Sc2cccc(OC)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.47
LMNA P02545 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.40
MTNR1A P48039 7/20 0.40
MTNR1B P49286 7/20 0.40
IDO1 P14902 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ACHE P22303 1/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37

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
SCHEMBL5850504 0.81 LMNA (0.43) LMNANPSR1L3MBTL1GAATSHR
SCHEMBL11099557 0.78 HCRTR1 (0.56) HCRTR1LMNANPSR1L3MBTL1POLB
SCHEMBL30729242 0.75 HCRTR1 (0.53) HCRTR1LMNANPSR1L3MBTL1POLB
SCHEMBL5850884 0.74 SRC (0.47) LMNAL3MBTL1GAATP53
SCHEMBL23163313 0.74 HCRTR1 (0.59) HCRTR1LMNANPSR1L3MBTL1POLB
SCHEMBL28661384 0.73 LMNA (0.44) HCRTR1LMNAL3MBTL1MTNR1AMTNR1B
SCHEMBL28031699 0.72 HCRTR1 (0.57) HCRTR1LMNANPSR1L3MBTL1POLB
SCHEMBL11763718 0.71 HCRTR1 (0.56) HCRTR1LMNANPSR1L3MBTL1IDO1
SCHEMBL28439575 0.71 INPPL1 (0.58) HCRTR1LMNAL3MBTL1GAARAB9A
SCHEMBL8016743 0.71 HCRTR1 (0.47) HCRTR1LMNANPSR1L3MBTL1SMN1; 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
US-5557003-A SOLVENT EXTRACTION OF ZINC FROM ORE ZENECA LIMITED (GB) 1996-09-17 US disclosed