SCHEMBL15957666

SCHEMBL15957666

Cc1ccc(C(C)(O)C(F)(F)F)c(C)c1N

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AR P10275 10/20 0.51
POLB P06746 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
ATM Q13315 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HSD11B1 P28845 4/20 0.33
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL15957866 0.83 SMN1; SMN2 (0.49) ARPOLBSMN1; SMN2ALDH1A1KDM4E
SCHEMBL15957653 0.82 AR (0.69) ARSMN1; SMN2HSD11B1
SCHEMBL12126475 0.80 AR (0.47) ARPOLBSMN1; SMN2ALDH1A1KDM4E
SCHEMBL15957691 0.79 AR (0.53) ARALDH1A1HSD11B1
SCHEMBL15957685 0.79 AR (0.57) ARPOLBSMN1; SMN2ALDH1A1KDM4E
SCHEMBL21416706 0.78 POLB (0.50) ARPOLBALDH1A1KDM4EMEN1
SCHEMBL15831662 0.76 AR (0.58) ARHSD11B1
SCHEMBL15957642 0.74 POLB (0.42) POLBMAPT
SCHEMBL15957645 0.74 AR (0.47) ARMEN1KMT2AHSD11B1
SCHEMBL15957701 0.73 AR (0.59) ARALDH1A1ATMHSD17B10HSD11B1

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-8809451-B2 Fluorinated dicarboxylic acid derivative and polymer obtained therefrom CENTRAL GLASS COMPANY, LIMITED (JP) 2014-08-19 US disclosed
US-20110301305-A1 Fluorinated Dicarboxylic Acid Derivative and Polymer Obtained Therefrom CENTRAL GLASS COMPANY, LIMITED (JP) 2011-12-08 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-20110301305-A1 Fluorinated Dicarboxylic Acid Derivative and Polymer Obtained Therefrom MCCC2, AFF2, F13A1 AR 4258/4885POLB 2721/4885SMN1; SMN2 3546/4885

“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.