SCHEMBL5520129

SCHEMBL5520129

C[C@@H]1CC2=CC(=O)CC[C@@H]2[C@@H]2[C@@H]1[C@@H]1CC[C@H](O)[C@@]1(C)C[C@H]2O

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 11/20 0.68
▸ SHBG P04278 7/20 0.50
▸ SLC22A1 O15245 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ SERPINA6 P08185 1/20 0.50
▸ THRB P10828 1/20 0.50
▸ NR3C1 P04150 6/20 0.43
▸ PGR P06401 3/20 0.41
▸ NR3C2 P08235 1/20 0.41
▸ CYP19A1 P11511 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
SCHEMBL14342103 1.00 AR (0.68) ARSHBGSLC22A1ALDH1A1SERPINA6
SCHEMBL6012356 0.92 AR (0.69) ARSHBGSLC22A1ALDH1A1SERPINA6
SCHEMBL12364347 0.92 AR (0.69) ARSHBGSLC22A1ALDH1A1SERPINA6
SCHEMBL6012294 0.92 AR (0.69) ARSHBGSLC22A1ALDH1A1SERPINA6
SCHEMBL24103283 0.92 AR (0.69) ARSHBGSLC22A1ALDH1A1SERPINA6
SCHEMBL24102490 0.92 AR (0.69) ARSHBGSLC22A1ALDH1A1SERPINA6
SCHEMBL24102641 0.92 AR (0.69) ARSHBGSLC22A1ALDH1A1SERPINA6
SCHEMBL24103277 0.92 AR (0.69) ARSHBGSLC22A1ALDH1A1SERPINA6
SCHEMBL2246608 0.92 AR (0.69) ARSHBGSLC22A1ALDH1A1SERPINA6
SCHEMBL12355430 0.92 AR (0.69) ARSHBGSLC22A1ALDH1A1SERPINA6

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-20070298456-A1 Microbiological process for the production of 7-substitued 11-hydroxy steroids, 7,17-substituted 11-halogen steroids, and uses thereof ZORN LUDWIG 2007-12-27 — — US disclosed
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