Sugi Predict

Sugi Predict / Compounds / SCHEMBL7703448

SCHEMBL7703448

SCHEMBL7703448

C=CC[C@@H](O)[C@H]1CC[C@@H]2[C@H]3[C@H](CC[C@@]21C)[C@H]1CCC(=O)C=C1C[C@H]3C

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 12/20 0.64
▸ PGR P06401 9/20 0.46
▸ NR3C2 P08235 3/20 0.46
▸ SHBG P04278 3/20 0.44
▸ SERPINA6 P08185 2/20 0.44
▸ SLC22A1 O15245 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ THRB P10828 1/20 0.44
▸ MAPT P10636 2/20 0.41
▸ LMNA P02545 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
SCHEMBL7703445 1.00 AR (0.64) ARPGRNR3C2SHBGSERPINA6
SCHEMBL7880073 1.00 AR (0.64) ARPGRNR3C2SHBGSERPINA6
SCHEMBL7705065 1.00 AR (0.64) ARPGRNR3C2SHBGSERPINA6
SCHEMBL6463754 0.88 AR (0.69) ARPGRNR3C2SHBGSERPINA6
SCHEMBL6462344 0.88 AR (0.69) ARPGRNR3C2SHBGSERPINA6
SCHEMBL7705054 0.87 AR (0.66) ARPGRNR3C2SHBGSERPINA6
SCHEMBL7705055 0.87 AR (0.66) ARPGRNR3C2SHBGSERPINA6
SCHEMBL7705129 0.87 AR (0.66) ARPGRNR3C2SHBGSERPINA6
SCHEMBL7705132 0.87 AR (0.66) ARPGRNR3C2SHBGSERPINA6
SCHEMBL6467075 0.85 AR (0.72) ARPGRNR3C2SHBGSERPINA6

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
EP-1163259-B1 14.BETA.,17-ALPHA-HYDROXYMETHYLANDROSTANE DERIVATIVES AS ANDROGENS AKZO NOBEL NV (NL) 2002-11-20 — — EP disclosed