SCHEMBL10070478

SCHEMBL10070478

CCCCOc1cc(COOCc2ccccc2)c(-c2ccccc2)c2cc3c(cc12)OC(OC)O3

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 2/20 0.33
CDK5R1 Q15078 2/20 0.33
GSK3B P49841 1/20 0.33
MTNR1A P48039 1/20 0.32
C5AR1 P21730 1/20 0.32
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
POLB P06746 1/20 0.30
TSHR P16473 1/20 0.30
CDK1 P06493 1/20 0.30
CCNB1 P14635 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
SCHEMBL10070993 0.83 CYP1A2 (0.43) BCHEACHE
SCHEMBL10070138 0.81 BCHE (0.36) BCHEACHE
SCHEMBL10041195 0.81 CDK5 (0.38) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL10070479 0.79 PTPN11 (0.40)
SCHEMBL10041198 0.78 CDK5 (0.42) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL10041199 0.76 CDK5 (0.39) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL10071039 0.74 BCHE (0.31) BCHEACHE
SCHEMBL10041197 0.73 ERN1 (0.39) CDK5CDK5R1GSK3BCDK1CCNB1
SCHEMBL9943147 0.71 CDK5 (0.33) CDK5CDK5R1GSK3BMTNR1ACDK1
SCHEMBL10041200 0.69 AKR1B1 (0.35) 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-20120161089-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2012-06-28 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-20120161089-A1 CHROMENE COMPOUND CYP8B1, HSD3B2, CYP17A1 CDK5 2524/4885CDK5R1 1160/4885GSK3B 1900/4885

“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.