SCHEMBL20965616

SCHEMBL20965616

C=CP(=O)(C=C)OC1CCCCC1.O=P(OC1CCCCC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
NPSR1 Q6W5P4 4/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
LMNA P02545 3/20 0.37
ALDH1A1 P00352 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
G6PC1 P35575 1/20 0.34
GAA P10253 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 2/20 0.33
ACHE P22303 1/20 0.33
FABP7 O15540 1/20 0.32
FABP5 Q01469 1/20 0.32
MAPT P10636 2/20 0.31
HTT P42858 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL779638 0.89 MEN1 (0.43) NPSR1MEN1KMT2ALMNAALDH1A1
SCHEMBL779901 0.82 ACHE (0.45) NPSR1MEN1KMT2ALMNAL3MBTL1
SCHEMBL779274 0.81 ALOX15 (0.41) ALOX15TSHRNPSR1MEN1KMT2A
SCHEMBL779674 0.79 L3MBTL1 (0.44) NPSR1MEN1KMT2ALMNAL3MBTL1
SCHEMBL29468674 0.75 KMT2A (0.36) NPSR1MEN1KMT2ALMNAALDH1A1
SCHEMBL777537 0.75 KMT2A (0.36) NPSR1MEN1KMT2ALMNAALDH1A1
SCHEMBL779700 0.72 ACHE (0.46) NPSR1MEN1KMT2ALMNAALDH1A1
SCHEMBL11340635 0.72 NPSR1 (0.44) NPSR1MEN1KMT2ALMNAL3MBTL1
SCHEMBL5420537 0.72 NPSR1 (0.44) NPSR1MEN1KMT2ALMNAL3MBTL1
SCHEMBL779210 0.71 NPSR1 (0.40) NPSR1MEN1KMT2ALMNAL3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10333172-B2 Non-aqueous liquid electrolyte and non-aqueous liquid electrolyte secondary battery MITSUBISHI CHEMICAL CORPORATION (JP) 2019-06-25 US disclosed
US-10290901-B2 2019-05-14 US disclosed