SCHEMBL17827907

SCHEMBL17827907

CCOC(=O)C1CC(C)(OCC)C1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
MAPT P10636 3/20 0.41
ALDH1A1 P00352 5/20 0.39
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL17820825 0.82 CYP3A4 (0.43) CYP3A4CYP2D6CYP2C9CYP2C19MAPT
SCHEMBL28451183 0.81 MAPT (0.46) CYP3A4CYP2D6CYP2C9CYP2C19MAPT
SCHEMBL16699574 0.80 CYP3A4 (0.44) CYP3A4CYP2D6CYP2C9CYP2C19MAPT
SCHEMBL20139837 0.79 CYP2C19 (0.46) CYP3A4CYP2D6CYP2C9CYP2C19MAPT
SCHEMBL16700910 0.78 CYP3A4 (0.43) CYP3A4CYP2D6CYP2C9CYP2C19MAPT
SCHEMBL11412055 0.77 CYP3A4 (0.42) CYP3A4CYP2D6CYP2C9CYP2C19MAPT
SCHEMBL422879 0.76 MAPT (0.46) CYP3A4CYP2D6CYP2C9CYP2C19MAPT
SCHEMBL1813546 0.76 CYP3A4 (0.44) CYP3A4CYP2D6CYP2C9CYP2C19MAPT
SCHEMBL1813544 0.76 CYP3A4 (0.44) CYP3A4CYP2D6CYP2C9CYP2C19MAPT
SCHEMBL21777465 0.74 CYP3A4 (0.43) CYP3A4CYP2D6CYP2C9CYP2C19MAPT

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-9586951-B2 Morpholine derivative or salt thereof FUJIFILM CORPORATION (JP) 2017-03-07 US disclosed
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2016-06-16 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-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF PRMT7, RBBP7, RER1 CYP3A4 3441/4885CYP2D6 1367/4885CYP2C9 4239/4885

“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.