SCHEMBL18270602

SCHEMBL18270602

CO[C@@H]1C(O)c2coc3c2[C@@](C)(c2ccc4c(c2C3=O)CCC4=O)[C@@H]1O

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APP P05067 6/20 0.68
PIK3CA P42336 4/20 0.62
AURKA O14965 1/20 0.62
CDK1 P06493 1/20 0.62
NEK2 P51955 1/20 0.62
PLK1 P53350 1/20 0.62
PIK3R1 P27986 2/20 0.42
EED O75530 3/20 0.38
SUZ12 Q15022 3/20 0.38
EZH2 Q15910 3/20 0.38
RBBP4 Q09028 1/20 0.38
RBBP7 Q16576 1/20 0.38
IDO1 P14902 8/20 0.36
TDO2 P48775 8/20 0.36
HIF1A Q16665 1/20 0.35
EPAS1 Q99814 1/20 0.35

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
SCHEMBL2258148 1.00 APP (0.68) APPPIK3CAAURKACDK1NEK2
SCHEMBL8226303 1.00 APP (0.68) APPPIK3CAAURKACDK1NEK2
SCHEMBL20203938 0.87 APP (0.51) APPPIK3CAAURKACDK1NEK2
SCHEMBL19194047 0.87 APP (0.71) APPPIK3CAAURKACDK1NEK2
SCHEMBL20199947 0.84 APP (0.68) APPPIK3CAAURKACDK1NEK2
Viridin SCHEMBL150042 0.81 APP (0.68) APPPIK3CAAURKACDK1NEK2
Viridin SCHEMBL12162187 0.81 APP (0.68) APPPIK3CAAURKACDK1NEK2
Viridin SCHEMBL150041 0.81 APP (0.68) APPPIK3CAAURKACDK1NEK2
SCHEMBL19198458 0.81 APP (1.00) APPPIK3CAAURKACDK1NEK2
SCHEMBL12464245 0.81 APP (1.00) APPPIK3CAAURKACDK1NEK2

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-11019825-B2 Product ALPHA BIOPESTICIDES LIMITED (GB) 2021-06-01 US disclosed
US-20180146683-A1 NEW PRODUCT ALPHA BIOPESTICIDES LIMITED (GB) 2018-05-31 US disclosed
WO-2016189329-A1 NEW PRODUCT ALPHA BIOPESTICIDES LIMITED (GB) 2016-12-01 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 (2 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-20180146683-A1 NEW PRODUCT CYP51A1, ERG28, FASN APP 2710/4885PIK3CA 2188/4885AURKA 1490/4885
US-11019825-B2 Product ERG28, FASN, CYP51A1 APP 1726/4885PIK3CA 2060/4885AURKA 1228/4885

“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.