SCHEMBL3074035

SCHEMBL3074035

COC(=O)c1c(C)cc(C2OCCO2)c(C2OCCO2)c1N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.38
ACHE P22303 1/20 0.38
HPGD P15428 4/20 0.36
POLB P06746 4/20 0.36
ALDH1A1 P00352 9/20 0.35
KDM4E B2RXH2 6/20 0.35
HSD17B10 Q99714 2/20 0.33
CFTR P13569 1/20 0.33
GAA P10253 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
CISD2 Q8N5K1 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
TP53 P04637 1/20 0.32
HTT P42858 1/20 0.32
GLO1 Q04760 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL3058533 0.85 KDM4E (0.39) HPGDPOLBALDH1A1KDM4EHSD17B10
SCHEMBL3058649 0.85 KDM4E (0.34) HPGDALDH1A1KDM4EHSD17B10CFTR
SCHEMBL3064004 0.77 SMN1; SMN2 (0.40) CYP3A4ACHEHPGDPOLBALDH1A1
SCHEMBL3076346 0.76 KDM4E (0.43) HPGDPOLBALDH1A1KDM4EHSD17B10
SCHEMBL3064685 0.75 KDM4E (0.39) HPGDPOLBALDH1A1KDM4EHSD17B10
SCHEMBL3076329 0.74 ALDH1A1 (0.38) HPGDPOLBALDH1A1KDM4EHSD17B10
SCHEMBL3071700 0.70 KDM4E (0.37) HPGDPOLBALDH1A1KDM4EHSD17B10
SCHEMBL31056174 0.68 KDM4E (0.50) HPGDALDH1A1KDM4EHSD17B10CFTR
SCHEMBL31562734 0.68 KDM4E (0.54) HPGDALDH1A1KDM4EHSD17B10CFTR
SCHEMBL27783481 0.66 MAPT (0.41) CYP3A4HPGDPOLBALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8399490-B2 Insecticides SYNGENTA CROP PROTECTION LLC (US) 2013-03-19 US disclosed
EP-2167484-B1 CONDENSED ANTHRANILAMIDE INSECTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2011-12-21 EP disclosed
US-20100273830-A1 NOVEL INSECTICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-10-28 US disclosed
EP-2167484-A2 CONDENSED ANTHRANILAMIDE INSECTICIDES Syngeta Participations AG (CH) 2010-03-31 EP disclosed
WO-2009010260-A2 CONDENSED ANTHRANILAMIDE INSECTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2009-01-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100273830-A1 NOVEL INSECTICIDES NR5A2, NR2C2, NOX5 CYP3A4 270/4885ACHE 134/4885HPGD 3689/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.