SCHEMBL13809834

SCHEMBL13809834

C[C@]12CCC3C4CCC(=O)C=C4C=CC3C1CCC2=O

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 4/20 0.58
▸ PGR P06401 3/20 0.58
▸ NR3C2 P08235 2/20 0.58
▸ CYP19A1 P11511 14/20 0.56
▸ SRD5A2 P31213 1/20 0.46

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
SCHEMBL1656805 1.00 AR (0.58) ARPGRNR3C2CYP19A1SRD5A2
SCHEMBL7698849 0.81 CYP19A1 (0.52) CYP19A1
SCHEMBL13217275 0.81 AR (0.57) ARPGRNR3C2CYP19A1
SCHEMBL2929841 0.81 AR (0.57) ARPGRNR3C2CYP19A1
SCHEMBL8402139 0.81 CYP19A1 (0.51) CYP19A1
SCHEMBL12638972 0.80 AR (0.56) ARPGRNR3C2CYP19A1
SCHEMBL11809654 0.80 PGR (0.64) ARPGRNR3C2CYP19A1
SCHEMBL2832958 0.79 SHBG (0.59) ARPGRNR3C2CYP19A1SRD5A2
SCHEMBL8402137 0.79 CYP19A1 (0.50) CYP19A1
SCHEMBL7698847 0.79 CYP19A1 (0.50) CYP19A1

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-20150094291-A1 Method and Substance for Improving the Emotional Development of an Infant Opendot Research Co Limited (GB) 2015-04-02 — — US disclosed
US-20150094291-A1 Method and Substance for Improving the Emotional Development of an Infant Opendot Research Co Limited (GB) 2015-04-02 — — US disclosed
EP-2070941-A1 Stereoselective synthesis of selective estrogen receptor down-regulators Bayer Schering Pharma Aktiengesellschaft (DE) 2009-06-17 — — 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-20150094291-A1 Method and Substance for Improving the Emotional Development of an Infant BDNF, SNAP29, GAP43 AR 4375/4885PGR 3277/4885NR3C2 582/4885

“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.

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