SCHEMBL6792432

SCHEMBL6792432

O=C(O)c1c2c(nn1C/C=N/O)-c1ccncc1CC2

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.32
GRK2 P25098 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
SCHEMBL6792436 1.00 ROCK2 (0.32) ROCK2GRK2
SCHEMBL6787073 0.87 ALDH1A1 (0.32) ROCK2GRK2
SCHEMBL6786987 0.86 ELANE (0.36)
SCHEMBL6786990 0.86 ELANE (0.36)
SCHEMBL6793189 0.82 CDK2 (0.35) ROCK2GRK2
SCHEMBL1655455 0.81 CDK2 (0.36) ROCK2GRK2
SCHEMBL6793304 0.81 KDM4C (0.37)
Hydrochloric Acid SCHEMBL4257712 0.80 CDK2 (0.36) ROCK2GRK2
SCHEMBL1659385 0.80 CDK2 (0.34) ROCK2GRK2
Hydrochloric Acid SCHEMBL1658167 0.78 CDK2 (0.42) ROCK2GRK2

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 claimed

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 ROCK2 317/4885GRK2 50/4885

“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.