SCHEMBL3437068

SCHEMBL3437068

CCOC(=O)C1(C(F)(F)F)CC(OC(=O)CC)O1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.35
POLB P06746 1/20 0.32
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
OPRK1 P41145 1/20 0.31
GRM1 Q13255 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 1/20 0.30
KDM4E B2RXH2 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
TSHR P16473 1/20 0.30
NFKB1 P19838 1/20 0.30
CYP2C19 P33261 1/20 0.30
RECQL P46063 1/20 0.30
TP53 P04637 1/20 0.30
MDM2 Q00987 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
SCHEMBL3438632 0.87 ATM (0.36) ATMPOLBOPRM1OPRD1OPRK1
SCHEMBL6447041 0.73 ATM (0.47) ATMPOLBOPRM1OPRD1OPRK1
SCHEMBL6447044 0.73 ATM (0.47) ATMPOLBOPRM1OPRD1OPRK1
SCHEMBL15957787 0.72 ATM (0.42) ATMPOLBOPRM1OPRD1OPRK1
SCHEMBL19400636 0.66
SCHEMBL23549956 0.65 TP53 (0.36) ATMPOLBOPRM1OPRD1OPRK1
SCHEMBL28266385 0.64 TP53 (0.35) ATMPOLBOPRM1OPRD1OPRK1
SCHEMBL27564583 0.63
SCHEMBL29187988 0.63 TP53 (0.35) ATMPOLBOPRM1OPRD1OPRK1
SCHEMBL24851098 0.63 TP53 (0.35) ATMPOLBOPRM1OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8809557-B2 Method for producing optically active fluorinated oxetane CENTRAL GLASS COMPANY, LIMITED (JP) 2014-08-19 US disclosed
US-8809557-B2 Method for producing optically active fluorinated oxetane CENTRAL GLASS COMPANY, LIMITED (JP) 2014-08-19 US disclosed
EP-2402328-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE FLUORINATED OXETANE Tokyo Institute of Technology (JP) 2012-01-04 EP disclosed
US-20110306781-A1 Method for Producing Optically Active Fluorinated Oxetane CENTRAL GLASS COMPANY, LIMITED (JP) 2011-12-15 US disclosed
US-20110306781-A1 Method for Producing Optically Active Fluorinated Oxetane CENTRAL GLASS COMPANY, LIMITED (JP) 2011-12-15 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-20110306781-A1 Method for Producing Optically Active Fluorinated Oxetane OXER1, FTO, CYP51A1 ATM 4506/4885POLB 3279/4885OPRM1 236/4885

“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.