SCHEMBL10977019

SCHEMBL10977019

CCOC(=O)CC(=O)C(C)Oc1ccc(Oc2cnc3cc(Cl)c(Cl)cc3n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ CYP1A2 P05177 3/20 0.53
▸ CYP3A4 P08684 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ HPGD P15428 2/20 0.53
▸ TP53 P04637 1/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ NFKB1 P19838 1/20 0.53
▸ HIF1A Q16665 1/20 0.53
▸ GMNN O75496 1/20 0.53
▸ APEX1 P27695 1/20 0.53
▸ PMP22 Q01453 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ KMT2A Q03164 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL10881162 0.86 ALDH1A1 (0.47) MAPTALDH1A1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL10882047 0.84 MAPT (0.60) MAPTALDH1A1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL10980558 0.83 MAPT (0.48) MAPTALDH1A1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL10976213 0.83 ALDH1A1 (0.50) MAPTALDH1A1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL11114792 0.82 ALDH1A1 (0.62) MAPTALDH1A1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL10709969 0.82 ALDH1A1 (0.62) MAPTALDH1A1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL10973359 0.81 MAPT (0.65) MAPTALDH1A1SMN1; SMN2CYP1A2CYP3A4
Hydrochloric Acid SCHEMBL10951561 0.81 ALDH1A1 (0.61) MAPTALDH1A1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL10979201 0.78 L3MBTL1 (0.68) MAPTSMN1; SMN2LMNAAPEX1L3MBTL1
Quizalofop Ethyl Ester SCHEMBL9139248 0.78 MAPT (0.67) MAPTALDH1A1SMN1; SMN2CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4561882-A HERBICIDES ZOECON CORPORATION (US) 1985-12-31 — — US disclosed
US-4529438-A A 1-(pyrid-2-yl-oxy-),4-(ester-keto-oxy)benzene compound ZOECON CORP. (US) 1985-07-16 — — US disclosed
US-4525205-A PRE- AND POSTEMERGENCE; WEED CONTROL ZOECON CORPORATION (US) 1985-06-25 — — US disclosed
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