SCHEMBL6409515

SCHEMBL6409515

CC(C)(C)OC(=O)C1CC1COC(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.39
HSD17B10 Q99714 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
CYP2C19 P33261 1/20 0.36
CHRNA7 P36544 1/20 0.36

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
SCHEMBL6409639 0.85 CYP3A4 (0.55) CYP1A2HSD17B10CYP3A4CYP2D6TSHR
SCHEMBL6407056 0.82 CA1 (0.45) TSHR
SCHEMBL6409587 0.81 FFAR4 (0.49) CYP1A2SLC6A4SLC6A3
SCHEMBL28741185 0.78 HRH3 (0.33) MAPK1
SCHEMBL6408121 0.78 CHRNA7 (0.35) CHRNA7
SCHEMBL6406457 0.77 CTSS (0.36) CYP1A2CYP2D6TSHRMAPK1SLC6A4
SCHEMBL28940568 0.77 L3MBTL1 (0.43) CTSS
SCHEMBL6409534 0.77 L3MBTL1 (0.43) CTSS
SCHEMBL26951492 0.77 L3MBTL1 (0.43) CTSS
SCHEMBL6407546 0.77 CYP2C19 (0.38) CYP2C19

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050288526-A1 Process for production of 2-(hydroxymethyl)cyclo-propanecarboxylic acids SUMITOMO CHEMICAL COMPAY LIMTED (JP) 2005-12-29 US disclosed
EP-1538141-A1 PROCESS FOR PRODUCTION OF 2-(HYDROXYMETHYL)CYCLO- PROPANECARBOXYLIC ACIDS Sumitomo Chemical Company, Limited (JP) 2005-06-08 EP 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-20050288526-A1 Process for production of 2-(hydroxymethyl)cyclo-propanecarboxylic acids GRHPR, PCCA, C5 CYP1A2 58/4885HSD17B10 209/4885CYP3A4 240/4885

“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.