SCHEMBL2819045

SCHEMBL2819045

COc1cccc(C=Cc2nc3c(OC)cccn3c(=O)c2-c2ccc(C#N)cc2)c1OC1CCCC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 1/20 0.34
ACMSD Q8TDX5 1/20 0.34
PDE4D Q08499 3/20 0.33
KDM1A O60341 4/20 0.33
DYRK1A Q13627 1/20 0.33
TNF P01375 1/20 0.32
LITAF Q99732 1/20 0.32
FPR2 P25090 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
PDE4B Q07343 2/20 0.32
PDE4A P27815 2/20 0.32
PDE4C Q08493 1/20 0.32
CYP11B2 P19099 1/20 0.32
CACNB4 O00305 1/20 0.32
CACNA1A O00555 1/20 0.32
CACNA1G O43497 1/20 0.32
CACNG3 O60359 1/20 0.32
CACNA1F O60840 1/20 0.32
CACNA1H O95180 1/20 0.32

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
SCHEMBL2819042 1.00 MDM2 (0.34) MDM2ACMSDPDE4DKDM1ADYRK1A
SCHEMBL2821318 0.91 KCNK3 (0.37) MDM2ACMSDKDM1ADYRK1AGAA
SCHEMBL2821317 0.91 KCNK3 (0.37) MDM2ACMSDKDM1ADYRK1AGAA
SCHEMBL16966528 0.88 ACMSD (0.34) MDM2ACMSDPDE4DKDM1ADYRK1A
SCHEMBL2820019 0.85 MDM2 (0.38) MDM2ACMSDPDE4DKDM1ADYRK1A
SCHEMBL2817948 0.82 LMNA (0.38) MAPT
SCHEMBL2817945 0.82 LMNA (0.38) MAPT
SCHEMBL2821320 0.82 NFE2L2 (0.39) MAPT
SCHEMBL2819037 0.81 LMNA (0.39) PDE4DMAPTPDE4BPDE4APDE4C
SCHEMBL2819041 0.81 LMNA (0.39) PDE4DMAPTPDE4BPDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8349846-B2 Fused pyrimidine derivatives as TRPV3 modulators GLENMARK PHARMACEUTICALS, S.A. (CH) 2013-01-08 US claimed
US-20100292254-A1 Fused Pyrimidine Derivatives as Trpv3 Modulators GLENMARK PHARMACEUTICALS, S.A. (CH) 2010-11-18 US claimed
US-8349846-B2 Fused pyrimidine derivatives as TRPV3 modulators GLENMARK PHARMACEUTICALS, S.A. (CH) 2013-01-08 US disclosed
US-20100292254-A1 Fused Pyrimidine Derivatives as Trpv3 Modulators GLENMARK PHARMACEUTICALS, S.A. (CH) 2010-11-18 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 (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-20100292254-A1 Fused Pyrimidine Derivatives as Trpv3 Modulators TRPV3, TRPV1, TRPV5 MDM2 3181/4885ACMSD 2961/4885PDE4D 1122/4885

“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.