SCHEMBL6791959

SCHEMBL6791959

CCOC(=O)c1c2c(nn1CCCNC(=O)OC(C)(C)C)C1=CN(C(c3ccccc3)(c3ccccc3)c3ccccc3)NC1CC2

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 0.37
SIGMAR1 Q99720 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
BRD4 O60885 4/20 0.33
CKS1B P61024 1/20 0.33
SKP1 P63208 1/20 0.33
SKP2 Q13309 1/20 0.33
KCNA3 P22001 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
SCHEMBL6798834 0.96 DRD2 (0.36) DRD2SIGMAR1KDM4EMAPTNPSR1
SCHEMBL6790817 0.88 DRD2 (0.35) DRD2SIGMAR1KDM4EMAPTNPSR1
SCHEMBL6794681 0.87 DRD2 (0.38) DRD2SIGMAR1CKS1BSKP1SKP2
SCHEMBL6793099 0.85 LMNA (0.36) KDM4EMAPTKCNA3
SCHEMBL6798581 0.84 OPRM1 (0.33) KDM4EMAPTKCNA3
SCHEMBL6790712 0.83 P2RY12 (0.34) KDM4EMAPT
SCHEMBL6793129 0.82 MEN1 (0.39) KDM4EMAPT
SCHEMBL6794835 0.81 OPRD1 (0.35) KDM4EMAPTKCNA3
SCHEMBL6791964 0.79 KDM4E (0.35) DRD2SIGMAR1KDM4EMAPTNPSR1
SCHEMBL6798838 0.75 ADORA1 (0.35) DRD2SIGMAR1KDM4EMAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 PHARMACIA CORPORATION 2004-07-01 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-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 MKNK2, MAPKAPK2, MAP3K2 DRD2 4396/4885SIGMAR1 4084/4885KDM4E 2167/4885

“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.