SCHEMBL9943147

SCHEMBL9943147

CCCCOc1cc(COOCc2ccccc2)c(-c2ccccc2)c2c3c(c(OC)cc12)OC(C)(C)C3

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 3/20 0.33
CDK5R1 Q15078 3/20 0.33
GSK3B P49841 2/20 0.33
EHMT2 Q96KQ7 4/20 0.32
CDK1 P06493 2/20 0.32
CCNB1 P14635 2/20 0.32
MTNR1A P48039 1/20 0.32
MAOB P27338 1/20 0.32
FFAR4 Q5NUL3 1/20 0.31
CYP1A1 P04798 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP1B1 Q16678 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL9943148 0.84 BCHE (0.34) FFAR4
SCHEMBL9943104 0.82 FFAR4 (0.37) FFAR4KMT2A
SCHEMBL9928254 0.79 CDK5 (0.39) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL9943124 0.79 FFAR4 (0.32) FFAR4
SCHEMBL9928252 0.77 CDK5 (0.39) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL9928255 0.75 CDK5 (0.37) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL10070478 0.71 CDK5 (0.33) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL9928253 0.69 ALDH1A1 (0.35) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL9928249 0.68 FFAR4 (0.38) FFAR4KMT2A
SCHEMBL9928250 0.66 FFAR4 (0.36) CDK5CDK5R1GSK3BCDK1CCNB1

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 299/4885GSK3B 3932/4885

“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.