SCHEMBL428282

SCHEMBL428282

CCN(CN)c1nc(N(CN)CN)nc(N(CN)CN)n1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
MAPT P10636 2/20 0.41
ALOX15 P16050 3/20 0.39
USP2 O75604 1/20 0.39
SLC29A1 Q99808 1/20 0.36
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA9 Q16790 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KDM4E B2RXH2 1/20 0.32
CRHR1 P34998 1/20 0.32
RAB9A P51151 1/20 0.32
TERT O14746 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
SCHEMBL469795 0.86 TSHR (0.33) TSHRTDP1MAPTSMN1; SMN2
SCHEMBL16558118 0.84 TSHR (0.36) TSHRTDP1MAPTALOX15USP2
SCHEMBL2741119 0.80 TDP1 (0.64) TSHRTDP1MAPTALOX15USP2
SCHEMBL2338559 0.74 MAPT (0.66) TSHRTDP1MAPTALOX15USP2
SCHEMBL11686007 0.70 LMNA (0.61) TSHRTDP1MAPTALOX15USP2
SCHEMBL14301471 0.70 TSHR (0.54) TSHRTDP1MAPTALOX15USP2
Meladrazine SCHEMBL25913 0.69 TSHR (0.47) TSHRTDP1MAPTALOX15USP2
SCHEMBL18055624 0.68 TDP1 (0.46) TSHRTDP1MAPTALOX15USP2
SCHEMBL2623089 0.68 TSHR (0.52) TSHRTDP1MAPTALOX15USP2
SCHEMBL2339204 0.68 MAPT (0.60) TSHRTDP1MAPTALOX15USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9221960-B2 Multifunctional melamine epoxy resins, methylols and amines EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2015-12-29 US disclosed
US-20150073103-A1 MULTIFUNCTIONAL MELAMINE EPOXY RESINS, METHYLOLS AND AMINES CRESTLINE DIRECT FINANCE, L.P. 2015-03-12 US disclosed
US-8911858-B2 Multifunctional melamine epoxy resins, methylols and amines EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2014-12-16 US disclosed
US-20140179838-A1 MULTIFUNCTIONAL MELAMINE EPOXY RESINS, METHYLOLS AND AMINES EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2014-06-26 US disclosed
US-20120063976-A1 METHODS OF REMOVING CARBON DIOXIDE AND SORBENTS FOR SAME BATTELLE ENERGY ALLIANCE, LLC (US) 2012-03-15 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-20140179838-A1 MULTIFUNCTIONAL MELAMINE EPOXY RESINS, METHYLOLS AND AMINES PNMT, HNMT, NNMT TSHR 2435/4885TDP1 2104/4885MAPT 2053/4885
US-20150073103-A1 MULTIFUNCTIONAL MELAMINE EPOXY RESINS, METHYLOLS AND AMINES PNMT, HNMT, NNMT TSHR 2435/4885TDP1 2104/4885MAPT 2053/4885
US-20120063976-A1 METHODS OF REMOVING CARBON DIOXIDE AND SORBENTS FOR SAME CHRM2, CHRM1, CHRM3 TSHR 587/4885TDP1 3486/4885MAPT 3538/4885

“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.