SCHEMBL5669232

SCHEMBL5669232

CC(=CC(C)OC(C)(C)C12CC3CC(CC(C3)C1)C2)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.33
THRB P10828 1/20 0.33
CYP2C9 P11712 1/20 0.33
MEN1 O00255 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 2/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL1218778 0.76 GLA (0.36) GLATHRBCYP2C9LMNAHTT
SCHEMBL1218862 0.72 ALDH1A1 (0.40) GLAMEN1KMT2ASMN1; SMN2
SCHEMBL642169 0.72
SCHEMBL13685322 0.72
SCHEMBL1219029 0.70 MEN1 (0.43) MEN1MAPK1KMT2ALMNAHTT
SCHEMBL5668285 0.70 MEN1 (0.43) MEN1MAPK1KMT2ALMNAHTT
SCHEMBL701599 0.70 THRB (0.35) GLATHRBCYP2C9MEN1MAPK1
SCHEMBL503560 0.70 THRB (0.35) GLATHRBCYP2C9MEN1MAPK1
SCHEMBL14410609 0.69
SCHEMBL1217756 0.69 ATM (0.34) MEN1KMT2A

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-20060160247-A1 Unsaturated carboxylic acid hemicacetal ester, polymeric compound and photoresist resin composition DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2006-07-20 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-20060160247-A1 Unsaturated carboxylic acid hemicacetal ester, polymeric compound and photoresist resin composition HCAR1, HCAR2, RARA GLA 892/4885THRB 3661/4885CYP2C9 590/4885

“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.