SCHEMBL1305251

SCHEMBL1305251

N#Cc1cccc(C(N)=NN)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 2/20 0.49
▸ GRIN2D O15399 2/20 0.45
▸ GRIN3B O60391 2/20 0.45
▸ GRIN1 Q05586 2/20 0.45
▸ GRIN2A Q12879 2/20 0.45
▸ GRIN2B Q13224 2/20 0.45
▸ GRIN2C Q14957 2/20 0.45
▸ GRIN3A Q8TCU5 2/20 0.45
▸ ENPP2 Q13822 1/20 0.43
▸ PRSS1 P07477 1/20 0.43
▸ ACR P10323 1/20 0.43
▸ CLK4 Q9HAZ1 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ VNN1 O95497 2/20 0.40
▸ GRM5 P41594 1/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ NOS3 P29474 2/20 0.39
▸ NOS1 P29475 2/20 0.39
▸ KAT6A Q92794 1/20 0.39
▸ ATIC P31939 1/20 0.38

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
SCHEMBL16572029 0.85 GSK3B (0.49) GSK3BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1421298 0.85 GSK3B (0.49) GSK3BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1421297 0.85 GSK3B (0.49) GSK3BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL9608570 0.77 PRSS1 (0.53) GSK3BPRSS1
SCHEMBL171168 0.77 GSK3B (0.61) GSK3BPOLBVNN1GRM5ATIC
SCHEMBL29858580 0.77 GSK3B (0.51) GSK3BGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL2041048 0.77 GSK3B (0.61) GSK3BPOLBVNN1GRM5ATIC
SCHEMBL1305151 0.76 NOS3 (0.53) GSK3BENPP2POLBIDO1NOS3
SCHEMBL4083136 0.76 GSK3B (0.58) GSK3BENPP2CLK4VNN1GRM5
Hydrochloric Acid SCHEMBL2869263 0.76 PRSS1 (0.55) GSK3BPRSS1

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-8053573-B2 Monomer 5, 6-diphenyl-1.2.4-traizinic derivatives and the use thereof PIERRE FABRE DERMO-COSMETIQUE (FR) 2011-11-08 — — US disclosed
EP-1751122-B1 MONOMER 5,6-DIPHENYL-1,2,4-TRIAZINIC DERIVATIVES AND THE USE THEREOF FABRE PIERRE DERMO COSMETIQUE (FR) 2010-03-17 — — EP disclosed
US-20080299055-A1 Monomer 5, 6-Diphenyl-1.2.4-Traizinic Derivatives and the Use Thereof PIERRE FABRE DERMO-COSMETIQUE (FR) 2008-12-04 — — US disclosed
EP-1751122-A1 MONOMER 5,6-DIPHENYL-1,2,4-TRIAZINIC DERIVATIVES AND THE USE THEREOF Pierre Fabre Dermo-Cosmetique (FR) 2007-02-14 — — EP disclosed
WO-2005121108-A1 MONOMER 5,6-DIPHENYL-1,2,4-TRIAZINIC DERIVATIVES AND THE USE THEREOF PIERRE FABRE DERMO-COSMETIQUE (FR) 2005-12-22 — — WO 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-20080299055-A1 Monomer 5, 6-Diphenyl-1.2.4-Traizinic Derivatives and the Use Thereof POT1, TELO2, CLIC1 GSK3B 4499/4885GRIN2D 3774/4885GRIN3B 4708/4885

“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.

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