SCHEMBL7700529

SCHEMBL7700529

C[C@@H]1CC2=CC(=O)CC[C@@H]2[C@H]2CC[C@@]3(C)[C@H]([C@H]4C[C@H]4[C@@H]3[C@@H](C)O)[C@@H]21

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 10/20 0.58
▸ PGR P06401 9/20 0.51
▸ NR3C2 P08235 2/20 0.46
▸ SHBG P04278 2/20 0.44
▸ SERPINA6 P08185 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ SLC22A1 O15245 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ CYP19A1 P11511 2/20 0.38
▸ MCL1 Q07820 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37

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
SCHEMBL7880069 1.00 AR (0.58) ARPGRNR3C2SHBGSERPINA6
SCHEMBL7700526 1.00 AR (0.58) ARPGRNR3C2SHBGSERPINA6
SCHEMBL7698731 1.00 AR (0.58) ARPGRNR3C2SHBGSERPINA6
SCHEMBL7698728 1.00 AR (0.58) ARPGRNR3C2SHBGSERPINA6
SCHEMBL6466916 0.82 AR (0.59) ARPGRNR3C2SHBGSERPINA6
SCHEMBL6466919 0.82 AR (0.59) ARPGRNR3C2SHBGSERPINA6
SCHEMBL7702784 0.81 AR (0.58) ARPGRNR3C2SHBGSERPINA6
SCHEMBL6464713 0.81 AR (0.58) ARPGRNR3C2SHBGSERPINA6
SCHEMBL7702783 0.81 AR (0.58) ARPGRNR3C2SHBGSERPINA6
SCHEMBL13334538 0.80 AR (0.56) 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
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