SCHEMBL20151076

SCHEMBL20151076

N=CN/N=C/c1cscc1/C=N/NC(=N)N

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
GAA P10253 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
MAOB P27338 1/20 0.30
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL21908576 0.90 KDM4E (0.38) KDM4EGAAL3MBTL1MAOBMEN1
SCHEMBL20151064 0.81 GAA (0.31) KDM4EGAAL3MBTL1MAOBMEN1
SCHEMBL20150967 0.81 GAA (0.35) KDM4EGAAL3MBTL1MAOBMEN1
SCHEMBL21908577 0.77 L3MBTL1 (0.38) KDM4EGAAL3MBTL1MEN1ALDH1A1
SCHEMBL20150963 0.76 POLB (0.57) KDM4EMAOBMEN1KMT2A
SCHEMBL20150962 0.75 POLB (0.37) KDM4EGAAL3MBTL1MAOBMEN1
SCHEMBL20150970 0.74 KDM4E (0.33) KDM4EMEN1MAPTKMT2A
SCHEMBL20151073 0.74 MAPT (0.46) KDM4EGAAMEN1ALDH1A1MAPT
SCHEMBL20150971 0.72 CTH (0.32)
SCHEMBL20150968 0.72 CTH (0.40) KDM4EMEN1MAPTKMT2A

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-20240067860-A1 COMPOSITIONS AND METHODS FOR CARBON DIOXIDE SOLIDIFICATION CHEVRON U.S.A. INC. 2024-02-29 US disclosed
US-10633332-B2 Guanidine compounds for removal of oxyanions from aqueous solutions and for carbon dioxide capture UT-BATTELLE, LLC (US) 2020-04-28 US disclosed
US-20180134655-A1 GUANIDINE COMPOUNDS FOR REMOVAL OF OXYANIONS FROM AQUEOUS SOLUTIONS AND FOR CARBON DIOXIDE CAPTURE U.S. DEPARTMENT OF ENERGY 2018-05-17 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-10633332-B2 Guanidine compounds for removal of oxyanions from aqueous solutions and for carbon dioxide capture GUCY1A1, GUCY1A2, GUCY1B1 KDM4E 1102/4885GAA 655/4885L3MBTL1 2462/4885
US-20180134655-A1 GUANIDINE COMPOUNDS FOR REMOVAL OF OXYANIONS FROM AQUEOUS SOLUTIONS AND FOR CARBON DIOXIDE CAPTURE GUCY1A1, GUCY1A2, GUCY1B1 KDM4E 1102/4885GAA 655/4885L3MBTL1 2462/4885

“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.