SCHEMBL2965257

SCHEMBL2965257

O=c1[nH]c(-c2ccc(F)cc2Cl)cn2ncnc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
MAPK14 Q16539 4/20 0.36
PIM1 P11309 2/20 0.36
MAPK13 O15264 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK11 Q15759 1/20 0.36
CSNK2A2 P19784 1/20 0.36
CSNK2B P67870 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
TP53 P04637 1/20 0.36
GSK3B P49841 2/20 0.35
PRKCB P05771 1/20 0.35
PRKCA P17252 1/20 0.35
NISCH Q9Y2I1 1/20 0.35
HSD11B1 P28845 1/20 0.34
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33

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
SCHEMBL2931014 0.88 KDM4E (0.53) KDM4EMAPK14PIM1CSNK2A2CSNK2B
SCHEMBL2930344 0.88 KIT (0.38) KDM4EMAPK14MAPK13MAPK12MAPK11
SCHEMBL2928858 0.74 MEN1 (0.37) TP53NISCHHSD11B1KDRPDE2A
SCHEMBL12552085 0.66 KDM4E (0.54) KDM4EHSD11B1CDK4CCND1MEN1
SCHEMBL2984544 0.66 F2RL3 (0.43) TP53KDRPDE10AMEN1GAA
SCHEMBL16589317 0.65 PTGDR2 (0.39) KDM4ETP53MAP4K4LRRK2KMT2A
SCHEMBL1514027 0.65 KDM4E (0.59) KDM4EMAPK14GSK3BGCGR
SCHEMBL3687396 0.61 KDM4E (0.55) KDM4ETP53GSK3BHSD11B1CDK4
SCHEMBL1513942 0.60 KDM4E (0.47) KDM4EMAPK14GCGR
SCHEMBL2931660 0.59 LMNA (0.51) KDM4EGSK3BHSD11B1RETMET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2229382-A1 TRIAZOLE DERIVATIVE, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, AND ELECTRONIC DEVICE Semiconductor Energy Laboratory Co, Ltd. (JP) 2010-09-22 EP disclosed
EP-2229392-A1 TRIAZOLOTRIAZINES AND TRIAZOLOPYRAZINES AND THEIR USE AS GSK3BETA INHIBITORS Bayer Schering Pharma Aktiengesellschaft (DE) 2010-09-22 EP disclosed
US-20090258877-A1 TRIAZOLOTRIAZINES AND TRIAZOLOPYRAZINES AND THEIR USE BAYER HEALTHCARE AG (DE) 2009-10-15 US disclosed
US-20090258877-A1 TRIAZOLOTRIAZINES AND TRIAZOLOPYRAZINES AND THEIR USE BAYER HEALTHCARE AG (DE) 2009-10-15 US disclosed
US-20090258877-A1 TRIAZOLOTRIAZINES AND TRIAZOLOPYRAZINES AND THEIR USE BAYER HEALTHCARE AG (DE) 2009-10-15 US disclosed
WO-2009081718-A1 TRIAZOLE DERIVATIVE, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, AND ELECTRONIC DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2009-07-02 WO disclosed
WO-2009074259-A1 TRIAZOLOTRIAZINES AND TRIAZOLOPYRAZINES AND THE USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-06-18 WO disclosed
WO-2009074259-A1 TRIAZOLOTRIAZINES AND TRIAZOLOPYRAZINES AND THE USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-06-18 WO disclosed
WO-2008117633-A1 COMPOSITION, METHOD FOR FABRICATING LIGHT-EMITTING ELEMENT, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, AND ELECTRONIC DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2008-10-02 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-20090258877-A1 TRIAZOLOTRIAZINES AND TRIAZOLOPYRAZINES AND THEIR USE THPO, IL5, TPMT KDM4E 4078/4885MAPK14 1328/4885PIM1 1036/4885

“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.