SCHEMBL6408748

SCHEMBL6408748

COc1ccc(C(OC2C(C(=O)O)C2(C)C)(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 2/20 0.39
EDNRB P24530 1/20 0.39
SLC6A11 P48066 6/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
KMT2A Q03164 1/20 0.39
SLC6A12 P48065 1/20 0.39
SLC6A13 Q9NSD5 1/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
MAPT P10636 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
ALOX15 P16050 1/20 0.37
APEX1 P27695 1/20 0.37
MAPK1 P28482 1/20 0.37
RECQL P46063 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL6406915 0.96 EDNRA (0.43) EDNRAEDNRBSLC6A11MEN1TP53
SCHEMBL6408329 0.73 SLC6A11 (0.47) EDNRAEDNRBSLC6A11MEN1TP53
SCHEMBL11440348 0.73 SMN1; SMN2 (0.45) MEN1KMT2ACA1CA2MAPT
SCHEMBL11450511 0.72 KIF11 (0.40) MEN1KMT2AALDH1A1HSD17B10CES2
SCHEMBL6317044 0.70 EDNRA (0.47) EDNRAEDNRBKMT2ACA1CA2
SCHEMBL6317175 0.70 EDNRA (0.47) EDNRAEDNRBKMT2ACA1CA2
SCHEMBL6317160 0.70 EDNRA (0.47) EDNRAEDNRBKMT2ACA1CA2
Hydrochloric Acid SCHEMBL11394887 0.69 EDNRA (0.46) EDNRAEDNRBKMT2ACA1CA2
SCHEMBL11453232 0.68 APLNR (0.33)
SCHEMBL11067225 0.67 LMNA (0.40) MEN1TP53CYP3A4KMT2AALDH1A1

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 EDNRA 2157/4885EDNRB 1401/4885SLC6A11 2935/4885

“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.