SCHEMBL35210764

SCHEMBL35210764

CC(C)n1cc(C=O)c2c(F)cc(Br)cc21

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ERN1 O75460 2/20 0.31

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
SCHEMBL35210914 0.81 ALDH1A1 (0.46) ALDH1A1KDM4EERN1
SCHEMBL35211202 0.77 MAP2K1 (0.35) ALDH1A1
SCHEMBL22939106 0.76 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2ERN1
SCHEMBL2594904 0.75 ERN1 (0.35) ALDH1A1ERN1
SCHEMBL670294 0.74 CYP2A6 (0.41) ALDH1A1SMN1; SMN2KDM4EERN1
SCHEMBL35211188 0.73 MAP2K1 (0.39) ALDH1A1SMN1; SMN2KDM4E
SCHEMBL35210704 0.73 NOTUM (0.37) ALDH1A1KDM4E
SCHEMBL19620973 0.73 GABRA1 (0.33)
SCHEMBL35210669 0.72 PTPN11 (0.38) ALDH1A1SMN1; SMN2KDM4E
SCHEMBL672866 0.71 CYP2A6 (0.41) ALDH1A1SMN1; SMN2KDM4E

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-20260125391-A1 PYRIMIDINE INDOLES AS CDK4 INHIBITORS INCYTE CORP (US) 2026-05-07 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-20260125391-A1 PYRIMIDINE INDOLES AS CDK4 INHIBITORS CDK4, CCNA1, CCNO ALDH1A1 577/4885SMN1; SMN2 3223/4885KDM4E 1827/4885

“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.