SCHEMBL7359734

SCHEMBL7359734

C[N+]1(C)C(=O)OC[C@@H]1c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 12/20 0.43
TSHR P16473 1/20 0.38
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL7358273 1.00 CYP19A1 (0.43) CYP19A1TSHRALOX15ALOX12GAA
SCHEMBL7363290 1.00 CYP19A1 (0.43) CYP19A1TSHRALOX15ALOX12GAA
SCHEMBL16226181 0.65 TSHR (0.37) TSHR
SCHEMBL485589 0.62 TAAR1 (0.56) CYP19A1GAAMAPT
SCHEMBL485591 0.62 TAAR1 (0.56) CYP19A1GAAMAPT
SCHEMBL1315541 0.62 TAAR1 (0.56) CYP19A1GAAMAPT
SCHEMBL577209 0.61 CYP19A1 (0.56) CYP19A1TSHR
SCHEMBL27477390 0.61 GAA (0.48) CYP19A1TSHRGAAMAPT
SCHEMBL14350752 0.60 TSHR (0.39) CYP19A1TSHRMAPT
SCHEMBL6048428 0.60 TSHR (0.48) CYP19A1TSHRGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6486193-B2 ANTIARTHRITIC AGENTS; ANTIINFLAMMATORY AGENTS AVENTIS PHARMACEUTICALS INC. 2002-11-26 US disclosed
US-20020037859-A1 3-substituted pyrrolidines useful as inhibitors of matrix metalloproteinases AVENTISUB INC. 2002-03-28 US disclosed
EP-1150951-A1 3-SUBSTITUTED PYRROLIDINES USEFUL AS INHIBITORS OF MATRIX METALLO-PROTEINASES Aventis Pharmaceuticals Inc. (US) 2001-11-07 EP disclosed
WO-2000040553-A1 3-SUBSTITUTED PYRROLIDINES USEFUL AS INHIBITORS OF MATRIX METALLO-PROTEINASES AVENTIS PHARMACEUTICALS INC. (US) 2000-07-13 WO 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-20020037859-A1 3-substituted pyrrolidines useful as inhibitors of matrix metalloproteinases MMP3, MMP1, MMP9 CYP19A1 436/4885TSHR 4400/4885ALOX15 457/4885

“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.