SCHEMBL9328668

SCHEMBL9328668

C=C(c1ccccc1OCOC)c1cccc(OC)c1OCOC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ PTPN1 P18031 1/20 0.41
▸ LMNA P02545 3/20 0.40
▸ HPGD P15428 1/20 0.39
▸ SCN9A Q15858 2/20 0.38
▸ KCNK3 O14649 1/20 0.37
▸ KCNK9 Q9NPC2 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ CTSD P07339 1/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ ADRB2 P07550 1/20 0.36
▸ ADRB1 P08588 1/20 0.36
▸ ADRB3 P13945 1/20 0.36
▸ NFE2L2 Q16236 1/20 0.36
▸ MAPK1 P28482 1/20 0.36

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
SCHEMBL9328352 0.90 NPC1 (0.39) SMN1; SMN2PTPN1LMNAHPGDNPC1
SCHEMBL9327318 0.85 CLCN2 (0.41) SMN1; SMN2PTPN1LMNAHPGDNPC1
SCHEMBL9325951 0.84 PTPN1 (0.47) SMN1; SMN2PTPN1LMNAHPGDSCN9A
SCHEMBL9327326 0.82 CLCN2 (0.41) SMN1; SMN2LMNAHPGDKCNK3KCNK9
SCHEMBL9325967 0.79 MAPT (0.50) SMN1; SMN2LMNAHPGDKCNK3KCNK9
SCHEMBL8481540 0.78 PTPN1 (0.50) SMN1; SMN2PTPN1HPGDSCN9ANPC1
SCHEMBL28586196 0.78 SMN1; SMN2 (0.65) SMN1; SMN2PTPN1LMNAHPGDNPC1
SCHEMBL7643473 0.77 LMNA (0.42) SMN1; SMN2PTPN1LMNAHPGDCTSD
SCHEMBL2047965 0.76 LMNA (0.38) SMN1; SMN2PTPN1LMNAHPGDCTSD
SCHEMBL3671710 0.75 SMN1; SMN2 (0.55) SMN1; SMN2PTPN1HPGDL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0403026-B1 12-Substituted-12H-dibenzo(D,G)(1,3)dioxocin-6-carboxylic acids, herbicidal compositions, and a method of controlling undesirable vegetation DOWELANCO (US) 1994-03-02 — — EP disclosed
US-5158597-A Herbicidal 12-substituted 12H-dibenzo[d,g]dioxocin-6-carboxylic acids THE DOW CHEMICAL COMPANY (US) 1992-10-27 — — US disclosed
US-5071465-A Preemergence; postemergence THE DOW CHEMICAL COMPANY (US) 1991-12-10 — — US disclosed
US-4999448-A ALKYLATION WITH PHENYLTHIOMETHYL LITHIUM COMPOUND, CYCLIZATION, INTERMEDIATES FOR HERBICIDES THE DOW CHEMICAL COMPANY (US) 1991-03-12 — — US disclosed
EP-0403026-A1 12-Substituted-12H-dibenzo(D,G)(1,3)dioxocin-6-carboxylic acids, herbicidal compositions, and a method of controlling undesirable vegetation DowElanco (US) 1990-12-19 — — EP disclosed
US-4938790-A Herbicidal 12-substituted 12H-dibenzo(D,G)(1,3)dioxocin-6-carboxylic acids THE DOW CHEMICAL COMPANY (US) 1990-07-03 — — US disclosed
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