SCHEMBL19959425

SCHEMBL19959425

COC(C(F)(F)F)P(=O)(O)O

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 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
SCHEMBL8373921 0.78 KDM4E (0.31) KDM4ETSHRTDP1
SCHEMBL8160250 0.78 KDM4E (0.31) KDM4ETSHRTDP1
SCHEMBL8372984 0.78 KDM4E (0.31) KDM4ETSHRTDP1
SCHEMBL19961857 0.76 KDM4E (0.33) KDM4ETSHRTDP1
SCHEMBL8155340 0.75 TSHR (0.37) KDM4ETSHRTDP1
SCHEMBL8373916 0.75 TSHR (0.37) KDM4ETSHRTDP1
SCHEMBL8372103 0.75 TSHR (0.37) KDM4ETSHRTDP1
SCHEMBL8376417 0.73 ALDH1A1 (0.36) KDM4ETSHRTDP1
SCHEMBL8376565 0.73 ALDH1A1 (0.36) KDM4ETSHRTDP1
SCHEMBL8153898 0.73 ALDH1A1 (0.36) KDM4ETSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002437-A1 ECTONUCLEOTIDASE INHIBITORS AND METHODS OF USE THEREOF ANTENGENE THERAPEUTICS LIMITED (CN) 2023-01-05 US disclosed
US-20220010040-A1 REMOVAL OF THIOCARBONYLTHIO END GROUPS FROM POLYMERS UNIV KING ABDULLAH SCI & TECH (SA) 2022-01-13 US disclosed
WO-2018119284-A1 ECTONUCLEOTIDASE INHIBITORS AND METHODS OF USE THEREOF CALITHERA BIOSCIENCES, INC. (US) 2018-06-28 WO disclosed
WO-2018049145-A1 ECTONUCLEOTIDASE INHIBITORS AND METHODS OF USE THEREOF CALITHERA BIOSCIENCES, INC. (US) 2018-03-15 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-20230002437-A1 ECTONUCLEOTIDASE INHIBITORS AND METHODS OF USE THEREOF NT5E, ENTPD5, NT5C2 KDM4E 2596/4885TSHR 2756/4885TDP1 504/4885

“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.