SCHEMBL6787540

SCHEMBL6787540

CCOC(=O)c1c2c(nn1CCCNC(=O)OC(C)(C)C)-c1cc(Br)c(OC)cc1CC2

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.39
SUV39H2 Q9H5I1 2/20 0.38
STING1 Q86WV6 2/20 0.38
BRD4 O60885 8/20 0.38
DYRK1A Q13627 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CPB2 Q96IY4 1/20 0.35

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
SCHEMBL6786821 0.95 SUV39H2 (0.39) DRD2SUV39H2STING1BRD4MAPT
SCHEMBL6794553 0.94 DRD2 (0.41) DRD2SUV39H2STING1BRD4DYRK1A
SCHEMBL6791824 0.90 DRD2 (0.41) DRD2SUV39H2STING1BRD4DYRK1A
SCHEMBL6791850 0.88 SUV39H2 (0.41) DRD2SUV39H2BRD4
SCHEMBL6787603 0.85 SUV39H2 (0.41) DRD2SUV39H2BRD4
SCHEMBL6787224 0.85 DRD2 (0.40) DRD2STING1BRD4DYRK1A
SCHEMBL6792664 0.82 DRD2 (0.38) DRD2STING1BRD4DYRK1A
SCHEMBL6790810 0.82 DRD2 (0.38) DRD2STING1BRD4DYRK1A
SCHEMBL6787885 0.82 DRD2 (0.37) DRD2STING1BRD4DYRK1A
SCHEMBL6793980 0.81 LATS1 (0.37) DRD2STING1BRD4DYRK1AKDM4E

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 2 patents. 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 claimed
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 4396/4885SUV39H2 3165/4885STING1 4141/4885

“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.