SCHEMBL19254092

SCHEMBL19254092

COc1ccc(-c2nc(C(N)=O)c3[nH]c(=O)n(-c4ccccc4OC)c3n2)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.81
ALDH1A1 P00352 3/20 0.81
HPGD P15428 3/20 0.81
GLA P06280 2/20 0.81
GAA P10253 2/20 0.81
SMN1; SMN2 Q16637 1/20 0.81
CSNK2A1 P68400 6/20 0.73
CSNK2A2 P19784 1/20 0.73
CSNK2B P67870 1/20 0.73
USP2 O75604 2/20 0.60
TSHR P16473 2/20 0.60
MAPK1 P28482 2/20 0.60
NPSR1 Q6W5P4 2/20 0.60
LMNA P02545 1/20 0.60
ESR1 P03372 1/20 0.60
TP53 P04637 1/20 0.60
MAPT P10636 1/20 0.60
HTT P42858 1/20 0.60
HDAC3 O15379 3/20 0.59
HDAC4 P56524 3/20 0.59

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
SCHEMBL300825 0.93 KDM4E (0.82) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL291560 0.92 KDM4E (0.81) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL19207435 0.92 KDM4E (0.80) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL300924 0.91 KDM4E (0.80) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL296461 0.90 KDM4E (0.81) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL301283 0.90 KDM4E (0.81) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL19254094 0.90 KDM4E (0.78) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL301183 0.90 KDM4E (0.86) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL297560 0.90 KDM4E (0.86) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL300856 0.89 KDM4E (0.76) KDM4EALDH1A1HPGDGLAGAA

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-10765681-B2 Purine compounds possessing anticancer activity ACADEMIA SINICA (TW) 2020-09-08 US disclosed
WO-2017136689-A1 PURINE COMPOUNDS POSSESSING ANTICANCER ACTIVITY ACADEMIA SINICA (TW) 2017-08-10 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-10765681-B2 Purine compounds possessing anticancer activity NTPCR, PNP, NUDT1 KDM4E 3979/4885ALDH1A1 247/4885HPGD 323/4885

“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.