SCHEMBL6714037

SCHEMBL6714037

CC1C[C@H]2[C@@H]3C(C)CC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]2(C)C1O

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 10/20 0.75
▸ PGR P06401 9/20 0.55
▸ NR3C2 P08235 2/20 0.55
▸ SHBG P04278 3/20 0.53
▸ SERPINA6 P08185 2/20 0.53
▸ SLC22A1 O15245 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ THRB P10828 1/20 0.53
▸ CYP19A1 P11511 2/20 0.44

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
SCHEMBL5024779 1.00 AR (0.75) ARPGRNR3C2SHBGSERPINA6
SCHEMBL5017775 1.00 AR (0.75) ARPGRNR3C2SHBGSERPINA6
SCHEMBL5017844 0.88 AR (0.68) ARPGRNR3C2SHBGSERPINA6
SCHEMBL5017880 0.86 AR (0.66) ARPGRNR3C2SHBGSERPINA6
SCHEMBL7879965 0.86 AR (0.66) ARPGRNR3C2SHBGSERPINA6
SCHEMBL6464801 0.86 AR (0.66) ARPGRNR3C2SHBGSERPINA6
SCHEMBL24102494 0.86 AR (1.00) ARPGRNR3C2SHBGSERPINA6
SCHEMBL24103286 0.86 AR (1.00) ARPGRNR3C2SHBGSERPINA6
SCHEMBL1255845 0.86 AR (1.00) ARPGRNR3C2SHBGSERPINA6
SCHEMBL14342101 0.86 AR (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1427748-A1 17ALPHA-HYDROXY-14BETA-STEROIDS WITH HORMONAL EFFECT Akzo Nobel N.V. (NL) 2004-06-16 — — EP disclosed
WO-2003022864-A1 17ALPHA-HYDROXY-14BETA-STEROIDS WITH HORMONAL EFFECT AKZO NOBEL N.V. (NL) 2003-03-20 — — WO disclosed
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