SCHEMBL4472190

SCHEMBL4472190

CC1OC(=O)N(C)C1(OC(F)(F)F)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.37
CTSD P07339 1/20 0.31
BACE1 P56817 1/20 0.31
BACE2 Q9Y5Z0 1/20 0.31
CETP P11597 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP9 P14780 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
SCHEMBL4459771 0.84 GRM2 (0.40) GRM2BACE1MMP2MMP3MMP9
SCHEMBL4460629 0.81 GRM2 (0.40) GRM2MMP2MMP3MMP9
SCHEMBL4445297 0.81 GRM2 (0.38) GRM2MMP2MMP3MMP9
SCHEMBL4463016 0.78 ALDH1A1 (0.36) GRM2BACE1
SCHEMBL4453549 0.70 SMN1; SMN2 (0.39) GRM2MMP2MMP3MMP9
SCHEMBL4452501 0.63 FAAH (0.35) GRM2BACE1MMP2MMP3MMP9
SCHEMBL4450103 0.61 GAA (0.40) GRM2BACE1MMP2MMP3MMP9
SCHEMBL4458256 0.59 IDH1 (0.39) MMP2MMP3MMP9
SCHEMBL4454486 0.58 GAA (0.35) GRM2BACE1MMP2MMP3MMP9
SCHEMBL4480093 0.58 ELANE (0.38) GRM2MMP2MMP3MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090137577-A1 HETEROCYCLIC COMPOUNDS PFIZER INC. 2009-05-28 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-20090137577-A1 HETEROCYCLIC COMPOUNDS CYP2D6, ABCG2, CYP2B6 GRM2 4432/4885CTSD 2068/4885BACE1 2191/4885

“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.