SCHEMBL21392349

SCHEMBL21392349

CCCCCCCC(CCCCCCC)n1cc(F)c(N)nc1=O

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.35
ADA P00813 5/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDR P35968 1/20 0.33
PDE2A O00408 2/20 0.33
CYP3A4 P08684 2/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALB P02768 1/20 0.33
TSHR P16473 1/20 0.33
HIF1A Q16665 1/20 0.33

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
SCHEMBL22060529 0.84 EP300 (0.34) EP300ADASMN1; SMN2KDRPDE2A
SCHEMBL24529739 0.84 EP300 (0.34) EP300ADASMN1; SMN2KDRPDE2A
SCHEMBL8269531 0.75 SMN1; SMN2 (0.40) EP300ADASMN1; SMN2PDE2ACYP3A4
SCHEMBL23809316 0.75 KDM4E (0.31) KDM4EALDH1A1HSD17B10TSHR
SCHEMBL18671993 0.74 FGFR1 (0.39) ADA
SCHEMBL19590215 0.74 FGFR1 (0.39) ADA
SCHEMBL20334783 0.74 FGFR1 (0.39) ADA
SCHEMBL22348797 0.73 GPR84 (0.37) SMN1; SMN2KDM4EALDH1A1
SCHEMBL23187794 0.73 GPR84 (0.37) SMN1; SMN2KDM4EALDH1A1
SCHEMBL23106274 0.73 KDM4E (0.31) KDM4EHSD17B10TSHR

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-11365211-B2 Stereoselective synthesis and process for the manufacturing of 2′-deoxynucleosides THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2022-06-21 US disclosed
US-20200361977-A1 STEREOSELECTIVE SYNTHESIS AND PROCESS FOR THE MANUFACTURING OF 2'-DEOXYNUCLEOSIDES THE USA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2020-11-19 US disclosed
US-20190290670-A1 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS IDENIX PHARMACEUTICALS LLC (US) 2019-09-26 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 (3 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-20190290670-A1 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS HAVCR2, HCCS, PYGL EP300 1865/4885ADA 26/4885SMN1; SMN2 2411/4885
US-11365211-B2 Stereoselective synthesis and process for the manufacturing of 2′-deoxynucleosides DCTD, DUT, TET1 EP300 3984/4885ADA 37/4885SMN1; SMN2 2387/4885
US-20200361977-A1 STEREOSELECTIVE SYNTHESIS AND PROCESS FOR THE MANUFACTURING OF 2'-DEOXYNUCLEOSIDES DCTD, DUT, TET1 EP300 4006/4885ADA 37/4885SMN1; SMN2 2350/4885

“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.