SCHEMBL20150962

SCHEMBL20150962

N=CN/N=C/c1cncc(/C=N/NC(=N)N)c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.37
KDM4E B2RXH2 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.32
GAA P10253 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CTH P32929 1/20 0.31
NOX1 Q9Y5S8 1/20 0.31
MAOB P27338 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 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
SCHEMBL20150963 0.83 POLB (0.57) POLBKDM4EMEN1KMT2AMAOB
SCHEMBL20150971 0.82 CTH (0.32) CTH
SCHEMBL20150969 0.76 RRM2 (0.35)
SCHEMBL20151076 0.75 KDM4E (0.33) KDM4EGAAL3MBTL1MEN1KMT2A
SCHEMBL27111325 0.73 POLB (0.37) POLBKDM4EMAOBMAPTLMNA
SCHEMBL20150968 0.73 CTH (0.40) POLBKDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL24211892 0.72 SMN1; SMN2 (0.60) POLBSMN1; SMN2GAAL3MBTL1MEN1
SCHEMBL21908577 0.72 L3MBTL1 (0.38) KDM4ESMN1; SMN2GAAL3MBTL1MEN1
SCHEMBL20150970 0.72 KDM4E (0.33) POLBKDM4EMEN1KMT2AMAPT
SCHEMBL20151064 0.72 GAA (0.31) KDM4EGAAL3MBTL1MEN1KMT2A

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 POLB 343/4885KDM4E 1102/4885SMN1; SMN2 1131/4885
US-20180134655-A1 GUANIDINE COMPOUNDS FOR REMOVAL OF OXYANIONS FROM AQUEOUS SOLUTIONS AND FOR CARBON DIOXIDE CAPTURE GUCY1A1, GUCY1A2, GUCY1B1 POLB 343/4885KDM4E 1102/4885SMN1; SMN2 1131/4885

“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.