SCHEMBL13064871

SCHEMBL13064871

COc1c(O)cc(C(=O)O)c(N)c1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.49
POLB P06746 1/20 0.49
TPMT P51580 5/20 0.47
TDP1 Q9NUW8 3/20 0.43
MAPT P10636 3/20 0.43
ALDH1A1 P00352 3/20 0.43
HSD17B10 Q99714 2/20 0.43
PKM P14618 1/20 0.41
CYP3A4 P08684 2/20 0.40
CASP7 P55210 2/20 0.40
PTGS2 P35354 2/20 0.40
MEN1 O00255 1/20 0.40
TNF P01375 1/20 0.40
HSPD1 P10809 1/20 0.40
THRB P10828 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
CASP1 P29466 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL13064873 0.87 TPMT (0.46) KDM4EPOLBTPMTTDP1MAPT
SCHEMBL10956453 0.81 KDM4E (0.52) KDM4EPOLBTPMTTDP1MAPT
SCHEMBL2034454 0.81 KDM4E (0.72) KDM4EPOLBTPMTTDP1MAPT
SCHEMBL856624 0.80 TPMT (0.49) KDM4EPOLBTPMTTDP1MAPT
SCHEMBL670626 0.79 TPMT (0.49) KDM4ETPMTTDP1MAPTHSD17B10
SCHEMBL11642461 0.79 KDM4E (0.46) KDM4EPOLBTDP1MAPTALDH1A1
SCHEMBL18669122 0.79 KDM4E (0.54) KDM4EPOLBTPMTTDP1MAPT
SCHEMBL18677627 0.78 MAPT (0.51) KDM4EPOLBTPMTTDP1MAPT
SCHEMBL28270343 0.75 KDM4E (0.54) KDM4EPOLBTPMTTDP1MAPT
SCHEMBL25378470 0.74 TPMT (0.47) KDM4EPOLBTPMTTDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120322717-A9 Compounds and assays for controlling Wnt activity ENZO BIOCHEM, INC. 2012-12-20 US disclosed
US-20100298200-A1 Compounds and assays for controlling Wnt activity LIU DAKAI 2010-11-25 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 (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-20120322717-A9 Compounds and assays for controlling Wnt activity WNT1, WNT3A, WNT3 KDM4E 4062/4885POLB 3310/4885TPMT 3617/4885
US-20100298200-A1 Compounds and assays for controlling Wnt activity WNT1, WNT3A, WNT3 KDM4E 4062/4885POLB 3310/4885TPMT 3617/4885

“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.