SCHEMBL20255138

SCHEMBL20255138

O=S1(=O)CCC(c2ccc(I)nc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
GLA P06280 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HIF1A Q16665 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SLC6A9 P48067 9/20 0.37
CDK4 P11802 1/20 0.36
CDK6 Q00534 1/20 0.36
MAPK1 P28482 3/20 0.33
KDM1A O60341 1/20 0.32
MAOB P27338 1/20 0.32
CYP11B2 P19099 1/20 0.32
IKBKE Q14164 1/20 0.32
TBK1 Q9UHD2 1/20 0.32
CHRNA7 P36544 1/20 0.31

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
SCHEMBL17420698 0.83 KDM4E (0.42) KDM4EGLAHTTKMT2ASMN1; SMN2
SCHEMBL21367862 0.80 KDM4E (0.47) KDM4EGLAHTTKMT2ASMN1; SMN2
SCHEMBL20037437 0.79 SLC6A9 (0.43) KDM4EGLAHTTKMT2ASMN1; SMN2
SCHEMBL16679203 0.79 TNKS (0.41) KDM4EGLAHTTKMT2ASMN1; SMN2
SCHEMBL22677822 0.78 HTT (0.54) KDM4EGLAHTTKMT2ASMN1; SMN2
SCHEMBL24107605 0.76 KDM4E (0.69) KDM4EGLAHTTKMT2ASMN1; SMN2
SCHEMBL20249129 0.76 KMT2A (0.36) KDM4EGLAHTTKMT2ASMN1; SMN2
SCHEMBL30292511 0.76 KDM4E (0.69) KDM4EGLAHTTKMT2ASMN1; SMN2
SCHEMBL20255477 0.75 ESR2 (0.50) KDM4EGLAHTTKMT2ASMN1; SMN2
SCHEMBL20037554 0.75 SLC18A3 (0.47) KDM4EGLAHTTKMT2ASMN1; SMN2

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-20180161329-A1 PYRIDO[3,4-D]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF TEIJIN PHARMA LIMITED (JP) 2018-06-14 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-20180161329-A1 PYRIDO[3,4-D]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF CDK4, CDK6, CDK16 KDM4E 470/4885GLA 3430/4885HTT 3754/4885

“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.