SCHEMBL27217836

SCHEMBL27217836

CC(C)(C)c1cc(NC(=O)O)n(-c2ccc(Cl)cc2)n1

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.72
MAPK13 O15264 9/20 0.72
MAPK12 P53778 9/20 0.72
MAPK11 Q15759 9/20 0.72
CDK8 P49336 1/20 0.67
DDR2 Q16832 2/20 0.64
MAPK9 P45984 1/20 0.64
JAK2 O60674 1/20 0.63
GAA P10253 1/20 0.62
SRC P12931 1/20 0.58

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
SCHEMBL1600309 0.90 CDK8 (0.82) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL1598998 0.87 CDK8 (0.66) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL1012719 0.87 MAPK13 (0.78) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL12245421 0.86 MAPK14 (0.88) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL3621438 0.86 CDK8 (0.67) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL3939655 0.84 MAPK14 (0.75) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL13199966 0.84 MAPK14 (0.63) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL1012997 0.84 MAPK14 (0.66) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL4520038 0.84 CDK8 (0.58) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL4502798 0.84 CDK8 (0.58) MAPK14MAPK13MAPK12MAPK11CDK8

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-20240158394-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. 2024-05-16 US disclosed
WO-2024059200-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2024-03-21 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-20240158394-A1 NEK7 INHIBITORS NEK7, NEK5, NEK1 MAPK14 694/4885MAPK13 670/4885MAPK12 1037/4885

“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.