SCHEMBL16226885

SCHEMBL16226885

COc1cc(OC)c(-c2c(C)cc(O)c3c2C(=O)c2cccc(O)c2C3=O)c(O)c1C(C)=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.53
PIM1 P11309 1/20 0.53
SLC37A4 O43826 6/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
MAPT P10636 4/20 0.44
ELANE P08246 3/20 0.44
CYP3A4 P08684 3/20 0.44
KDM4E B2RXH2 3/20 0.44
RECQL P46063 3/20 0.44
ALDH1A1 P00352 3/20 0.44
TSHR P16473 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
MAPK1 P28482 2/20 0.44
CTSG P08311 1/20 0.44
USP2 O75604 1/20 0.44
BRCA1 P38398 1/20 0.44
POLB P06746 2/20 0.43
PABPC1 P11940 1/20 0.43
EIF4H Q15056 1/20 0.43

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
Knipholone SCHEMBL16226780 0.94 EGFR (0.51) EGFRPIM1SLC37A4MEN1KMT2A
SCHEMBL16226688 0.94 EGFR (0.53) EGFRPIM1SLC37A4MEN1KMT2A
SCHEMBL16225839 0.83 EGFR (0.46) EGFRPIM1SLC37A4MEN1KMT2A
Gaboroquinone B SCHEMBL16226258 0.82 EGFR (0.49) EGFRPIM1SLC37A4MEN1KMT2A
SCHEMBL16226796 0.81 MAPT (0.53) EGFRPIM1MEN1KMT2AMAPT
SCHEMBL16226859 0.81 EGFR (0.56) EGFRPIM1SLC37A4MEN1KMT2A
SCHEMBL16432934 0.80 MAPT (0.56) EGFRPIM1SLC37A4MEN1KMT2A
SCHEMBL16226909 0.77 EGFR (0.44) EGFRPIM1SLC37A4MEN1KMT2A
SCHEMBL16226019 0.76 CYP3A4 (0.42) EGFRPIM1SLC37A4MEN1KMT2A
Islandicin SCHEMBL9172900 0.74 MAPT (0.68) EGFRPIM1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER THE GENERAL HOSPITAL CORPORATION (US) 2014-11-13 US 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-20140335050-A1 METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF CANCER IL2RA, CD74, IL2 EGFR 656/4885PIM1 4333/4885SLC37A4 4856/4885

“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.