SCHEMBL9634038

SCHEMBL9634038

CCC1(c2ccc(N)cc2)CC(=O)NC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 19/20 1.00
CYP3A4 P08684 2/20 0.72
CYP17A1 P05093 1/20 0.72
CYP11A1 P05108 1/20 0.72
TBXAS1 P24557 1/20 0.72
PMP22 Q01453 1/20 0.72
PDE4D Q08499 1/20 0.72
PDE3A Q14432 1/20 0.72
NFKB1 P19838 1/20 0.72

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
SCHEMBL20135217 0.85 CYP19A1 (0.73) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
Aminoglutethimide SCHEMBL4306 0.84 CYP19A1 (1.00) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
SCHEMBL28215640 0.84 CYP19A1 (0.72) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
Aminoglutethimide SCHEMBL116988 0.84 CYP19A1 (1.00) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
Aminoglutethimide SCHEMBL7728932 0.84 CYP19A1 (1.00) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
Aminoglutethimide SCHEMBL1230613 0.84 CYP19A1 (1.00) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
SCHEMBL9017823 0.83 CYP19A1 (0.71) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
SCHEMBL11840135 0.83 CYP19A1 (0.71) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
SCHEMBL11841553 0.83 CYP19A1 (0.71) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1
Aminoglutethimide SCHEMBL28457203 0.83 CYP19A1 (0.97) CYP19A1CYP3A4CYP17A1CYP11A1TBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0516278-A1 Use of anti-mullerian hormone for reversal of female sexual phenotype in poultry MERCK & CO. INC. (US) 1992-12-02 EP claimed
EP-0514015-A1 Control of sex differentiation in fish MERCK & CO. INC. (US) 1992-11-19 EP claimed
US-5162337-A Administering Steroid Biosynthesis Inhibitors MERCK & CO., INC. (US) 1992-11-10 US claimed
WO-1992018132-A1 PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF BENIGN PROSTATIC HYPERPLASIA COMTAINING A 5 ALPHA-REDUCTASE INHIBITOR MERCK & CO., INC. (US) 1992-10-29 WO claimed
EP-0479570-A2 Animal growth promotion with aromatase inhibitors MERCK & CO. INC. (US) 1992-04-08 EP claimed
EP-0433084-A2 Use of aromatese inhibitors for the reversal of female sexual phenotype in poultry MERCK & CO. INC. (US) 1991-06-19 EP claimed
EP-0516278-A1 Use of anti-mullerian hormone for reversal of female sexual phenotype in poultry MERCK & CO. INC. (US) 1992-12-02 EP disclosed
EP-0514015-A1 Control of sex differentiation in fish MERCK & CO. INC. (US) 1992-11-19 EP disclosed
US-5162337-A Administering Steroid Biosynthesis Inhibitors MERCK & CO., INC. (US) 1992-11-10 US disclosed
WO-1992018132-A1 PHARMACEUTICAL COMBINATION FOR THE TREATMENT OF BENIGN PROSTATIC HYPERPLASIA COMTAINING A 5 ALPHA-REDUCTASE INHIBITOR MERCK & CO., INC. (US) 1992-10-29 WO disclosed
EP-0479570-A2 Animal growth promotion with aromatase inhibitors MERCK & CO. INC. (US) 1992-04-08 EP disclosed
EP-0433084-A2 Use of aromatese inhibitors for the reversal of female sexual phenotype in poultry MERCK & CO. INC. (US) 1991-06-19 EP disclosed