SCHEMBL9928252

SCHEMBL9928252

COc1cc2c(OCc3ccccc3)cc(OC=O)c(-c3ccccc3)c2c2c1OC(C)(C)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 4/20 0.39
CDK5R1 Q15078 4/20 0.39
CDK1 P06493 4/20 0.39
CCNB1 P14635 4/20 0.39
GSK3B P49841 4/20 0.38
MAOB P27338 1/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP1A1 P04798 2/20 0.35
CYP1A2 P05177 2/20 0.35
PTPN1 P18031 1/20 0.35
ERN1 O75460 1/20 0.34
CCNE2 O96020 1/20 0.34
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
CISD1 Q9NZ45 1/20 0.34

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
SCHEMBL9928254 0.85 CDK5 (0.39) CDK5CDK5R1CDK1CCNB1GSK3B
SCHEMBL9928251 0.84 CDK5 (0.38) CDK5CDK5R1CDK1CCNB1GSK3B
SCHEMBL9928250 0.84 FFAR4 (0.36) CDK5CDK5R1CDK1CCNB1GSK3B
SCHEMBL9928255 0.80 CDK5 (0.37) CDK5CDK5R1CDK1CCNB1GSK3B
SCHEMBL9943147 0.77 CDK5 (0.33) CDK5CDK5R1CDK1CCNB1GSK3B
SCHEMBL9943148 0.73 BCHE (0.34) PTPN1FFAR4
SCHEMBL9943104 0.73 FFAR4 (0.37) KMT2AFFAR4CNR2
SCHEMBL25954050 0.71 NPC1 (0.48) CDK5CDK5R1CDK1CCNB1GSK3B
SCHEMBL9928249 0.71 FFAR4 (0.38) MEN1KMT2APDE4APDE4BPDE4C
SCHEMBL9928253 0.71 ALDH1A1 (0.35) CDK5CDK5R1CDK1CCNB1GSK3B

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-20120145974-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2012-06-14 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-20120145974-A1 CHROMENE COMPOUND CRY2, CYP2J2, NR0B2 CDK5 765/4885CDK5R1 299/4885CDK1 57/4885

“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.