SCHEMBL17333323

SCHEMBL17333323

[O]P(=O)(OCCc1ccccc1)OCCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.47
▸ CA2 P00918 2/20 0.47
▸ CA9 Q16790 2/20 0.47
▸ TSHR P16473 2/20 0.45
▸ TDP1 Q9NUW8 1/20 0.44
▸ CA12 O43570 1/20 0.43
▸ CA7 P43166 1/20 0.43
▸ IDO1 P14902 1/20 0.42
▸ HCAR2 Q8TDS4 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ CASP1 P29466 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ FFAR1 O14842 1/20 0.41
▸ ESR1 P03372 1/20 0.41

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
SCHEMBL17333278 0.88 L3MBTL1 (0.54) TSHRIDO1L3MBTL1NPC1RAB9A
SCHEMBL2817045 0.84 CA1 (0.48) CA1CA2CA9TSHRTDP1
SCHEMBL9555706 0.81 CA1 (0.46) CA1CA2CA9TSHRTDP1
SCHEMBL6250234 0.81 CA1 (0.46) CA1CA2CA9TSHRTDP1
SCHEMBL3366798 0.81 CA1 (0.46) CA1CA2CA9TSHRTDP1
SCHEMBL516899 0.81 TSHR (0.53) CA1CA2CA9TSHRTDP1
SCHEMBL28581920 0.81 CA2 (0.50) CA1CA2CA9TSHRTDP1
SCHEMBL1319783 0.81 TSHR (0.64) CA1CA2CA9TSHRTDP1
SCHEMBL6830497 0.79 CA1 (0.44) CA1CA2CA9TSHRTDP1
SCHEMBL3472682 0.79 MEN1 (0.63) CA1CA2CA9TSHRTDP1

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-10439252-B2 Electrolyte solution for electrochemical device, and electrochemical device FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-10-08 — — US disclosed
US-20150364792-A1 ELECTROLYTE SOLUTION FOR ELECTROCHEMICAL DEVICE, AND ELECTROCHEMICAL DEVICE WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2015-12-17 — — US disclosed
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