SCHEMBL4446595

SCHEMBL4446595

COC(=O)C(C)OC([O])=O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.42
CA14 Q9ULX7 2/20 0.39
CA12 O43570 1/20 0.37
ALDH1A1 P00352 2/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31

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
SCHEMBL10012464 0.81 SMN1; SMN2 (0.44) SMN1; SMN2CA14CA12ALDH1A1KMT2A
SCHEMBL866170 0.79 TSHR (0.50) SMN1; SMN2CA14CA12ALDH1A1KMT2A
SCHEMBL5864497 0.79 TSHR (0.50) SMN1; SMN2CA14CA12ALDH1A1KMT2A
SCHEMBL10017663 0.79 SMN1; SMN2 (0.42) SMN1; SMN2CA14CA12ALDH1A1KMT2A
SCHEMBL13741176 0.79 SMN1; SMN2 (0.42) SMN1; SMN2CA14CA12ALDH1A1KMT2A
SCHEMBL13741138 0.79 SMN1; SMN2 (0.42) SMN1; SMN2CA14CA12ALDH1A1KMT2A
SCHEMBL4453532 0.77 SMN1; SMN2 (0.41) SMN1; SMN2CA14CA12ALDH1A1KMT2A
SCHEMBL22356006 0.77 CA14 (0.43) SMN1; SMN2CA14CA12ALDH1A1TSHR
SCHEMBL22356151 0.77 CA14 (0.43) SMN1; SMN2CA14CA12ALDH1A1TSHR
SCHEMBL4446060 0.77 SMN1; SMN2 (0.41) SMN1; SMN2CA14CA12ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629494-B2 Process for producing cyclopropylphenol derivative MITSUI CHEMICALS AGRO, INC. (JP) 2009-12-08 US disclosed
US-20090054681-A1 Production Process of cyclopropylphenol derivatives SANKYO AGRO COMPANY, LIMITED (JP) 2009-02-26 US disclosed
EP-1880987-A1 PROCESS FOR PRODUCING CYCLOPROPYLPHENOL DERIVATIVE Sankyo Agro Company, Limited (JP) 2008-01-23 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-20090054681-A1 Production Process of cyclopropylphenol derivatives CBR3, CYP4X1, CYP4A11 SMN1; SMN2 4833/4885CA14 1748/4885CA12 606/4885

“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.