SCHEMBL30134945

SCHEMBL30134945

CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(Br)cc1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 3/20 0.69
FPR2 P25090 10/20 0.61
EGFR P00533 2/20 0.59
CTSS P25774 2/20 0.53
CTSK P43235 2/20 0.53
CTSL P07711 1/20 0.53
CTSB P07858 1/20 0.53
LMNA P02545 1/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
XBP1 P17861 1/20 0.52
MAPK1 P28482 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
MAP1LC3B Q9GZQ8 1/20 0.51
MAP1LC3A Q9H492 1/20 0.51

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
SCHEMBL25008453 0.88 AAK1 (0.57) AAK1FPR2EGFRCTSSCTSK
SCHEMBL31433059 0.88 AAK1 (0.57) AAK1FPR2EGFRCTSSCTSK
SCHEMBL9490468 0.88 AAK1 (0.62) AAK1FPR2EGFRCTSSCTSK
SCHEMBL9610763 0.87 CTSK (0.59) AAK1EGFRCTSSCTSKCTSL
SCHEMBL9609480 0.87 CTSK (0.59) AAK1EGFRCTSSCTSKCTSL
SCHEMBL21643188 0.86 AAK1 (0.55) AAK1FPR2EGFRCTSSCTSK
SCHEMBL4423023 0.86 AAK1 (0.55) AAK1FPR2EGFRCTSSCTSK
SCHEMBL30135004 0.86 CTSS (0.52) AAK1FPR2EGFRCTSSCTSK
SCHEMBL30134835 0.86 CTSS (0.52) AAK1FPR2EGFRCTSSCTSK
SCHEMBL31064845 0.85 AAK1 (0.54) AAK1FPR2EGFRCTSSCTSK

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-20250243196-A1 CITRON KINASE INHIBITORS THE CLEVELAND CLINIC FOUNDATION 2025-07-31 US disclosed
WO-2022216717-A1 CITRON KINASE INHIBITORS THE CLEVELAND CLINIC FOUNDATION (US) 2022-10-13 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-20250243196-A1 CITRON KINASE INHIBITORS CHEK2, CILK1, DCK AAK1 436/4885FPR2 4605/4885EGFR 645/4885

“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.