SCHEMBL4480093

SCHEMBL4480093

CN1C(=O)OC(C)(Cl)C1(Cl)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.38
CTSG P08311 1/20 0.38
PRTN3 P24158 1/20 0.38
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GRM2 Q14416 1/20 0.37
HSD11B1 P28845 5/20 0.36
FAAH O00519 2/20 0.35
MGLL Q99685 2/20 0.35
MMP2 P08253 2/20 0.35
MMP9 P14780 2/20 0.35
MMP3 P08254 1/20 0.35
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
LPL P06858 1/20 0.33
LIPG Q9Y5X9 1/20 0.33
MMP1 P03956 1/20 0.32
ADAM17 P78536 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
SCHEMBL4480090 0.76 HSD11B1 (0.36) ELANECTSGPRTN3GRM2HSD11B1
SCHEMBL4450103 0.73 GAA (0.40) ELANECTSGPRTN3GAAL3MBTL1
SCHEMBL4454486 0.70 GAA (0.35) ELANECTSGPRTN3GAAL3MBTL1
SCHEMBL4460824 0.69 GAA (0.42) ELANECTSGPRTN3GAAL3MBTL1
SCHEMBL4458256 0.68 IDH1 (0.39) HSD11B1MMP2MMP9MMP3ALDH1A1
SCHEMBL4454824 0.68 GRM2 (0.40) GRM2HSD11B1MMP2MMP9MMP3
SCHEMBL4452493 0.67 MMP2 (0.41) ELANECTSGPRTN3GAAL3MBTL1
SCHEMBL4450100 0.64 HSD11B1 (0.37) ELANECTSGPRTN3HSD11B1MMP2
SCHEMBL28376028 0.58 ALDH1A1 (0.45) MMP2MMP9MMP3ALDH1A1NPC1
Tannin Pyrogallol SCHEMBL28146848 0.58 ALDH1A1 (0.69) GAAL3MBTL1MGLLMMP3ALDH1A1

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 ELANE 1155/4885CTSG 1928/4885PRTN3 2438/4885

“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.