SCHEMBL6840974

SCHEMBL6840974

C[C@H]1C[C@]2(C)C(=O)CC[C@H]2[C@@H]2C=CC3=CC(=O)CC[C@@H]3[C@H]21

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 17/20 0.47
▸ PGR P06401 2/20 0.41
▸ AR P10275 2/20 0.41
▸ NR3C2 P08235 1/20 0.41

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
SCHEMBL908462 0.87 CYP19A1 (0.46) CYP19A1PGRARNR3C2
SCHEMBL6913702 0.87 CYP19A1 (0.46) CYP19A1PGRARNR3C2
SCHEMBL13804522 0.87 CYP19A1 (0.46) CYP19A1PGRARNR3C2
SCHEMBL4587495 0.82 CYP19A1 (0.44) CYP19A1PGRARNR3C2
SCHEMBL6841601 0.79 AR (0.48) CYP19A1PGRARNR3C2
SCHEMBL13400874 0.79 AR (0.48) CYP19A1PGRARNR3C2
SCHEMBL13809834 0.79 AR (0.58) CYP19A1PGRARNR3C2
SCHEMBL1656805 0.79 AR (0.58) CYP19A1PGRARNR3C2
SCHEMBL6297465 0.74 AR (0.47) PGRARNR3C2
SCHEMBL7536116 0.74 AR (0.47) PGRARNR3C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040209853-A1 Orally active 7.alpha.-alkyl androgens AKZO NOBEL N.V. (NL) 2004-10-21 — — US disclosed
US-6756366-B1 19-NORTESTOSTERONE DERIVATIVES; ORALLY ACTIVE; HIGH POTENCY AKZO NOBEL N.V. (NL) 2004-06-29 — — US disclosed
EP-1212345-B1 ORALLY ACTIVE 7-ALPHA-ALKYL ANDROGENS AKZO NOBEL NV (NL) 2003-08-06 — — EP 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-20040209853-A1 Orally active 7.alpha.-alkyl androgens NR5A1, AR, SHBG CYP19A1 11/4885PGR 151/4885AR 2/4885

“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.

Send feedback