SCHEMBL7197702

SCHEMBL7197702

C[C@]12C=CC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](CC(=O)O)CC[C@@H]12

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GPBAR1 Q8TDU6 1/20 0.40
SRD5A2 P31213 1/20 0.40

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
SCHEMBL7195422 0.89 GPBAR1 (0.43) ARMEN1KMT2AGPBAR1
SCHEMBL3486294 0.86 GRIN1 (0.47) ARGPBAR1
SCHEMBL7196165 0.83 AR (0.44) ARGPBAR1
SCHEMBL7196166 0.83 AR (0.44) ARGPBAR1
SCHEMBL6839046 0.83 AKR1B10 (0.49) GPBAR1SRD5A2
SCHEMBL6839045 0.83 AKR1B10 (0.49) GPBAR1SRD5A2
SCHEMBL15259496 0.82 AR (0.61) ARGPBAR1
SCHEMBL7193192 0.82 AR (0.61) ARGPBAR1
SCHEMBL867595 0.82 AR (0.61) ARGPBAR1
SCHEMBL2545024 0.82 AR (0.61) ARGPBAR1

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-20030134828-A1 Composition and method for increasing in vivo androgen concentration ROBERTS WILLIAM J (US) 2003-07-17 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-20030134828-A1 Composition and method for increasing in vivo androgen concentration SHBG, CYP21A2, CYP19A1 AR 6/4885MEN1 580/4885KMT2A 2352/4885

“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.