SCHEMBL7618203

SCHEMBL7618203

C=C1C=C2CC(C)[C@@H]3[C@H](CC[C@]4(C)C(=O)CC[C@@H]34)[C@H]2CC1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 14/20 0.51
▸ AR P10275 5/20 0.51
▸ PGR P06401 4/20 0.46
▸ NR3C2 P08235 2/20 0.46

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
SCHEMBL5974440 1.00 CYP19A1 (0.51) CYP19A1ARPGRNR3C2
SCHEMBL7080880 0.88 CYP19A1 (0.67) CYP19A1ARPGRNR3C2
SCHEMBL13216950 0.88 CYP19A1 (0.67) CYP19A1ARPGRNR3C2
SCHEMBL14342104 0.88 CYP19A1 (0.67) CYP19A1ARPGRNR3C2
SCHEMBL5157184 0.88 CYP19A1 (0.67) CYP19A1ARPGRNR3C2
SCHEMBL29008753 0.88 CYP19A1 (0.67) CYP19A1ARPGRNR3C2
SCHEMBL5017877 0.88 CYP19A1 (0.67) CYP19A1ARPGRNR3C2
SCHEMBL6386655 0.79 AR (0.52) CYP19A1AR
SCHEMBL5974319 0.77 AR (0.50) ARPGRNR3C2
SCHEMBL6840796 0.77 AR (0.50) ARPGRNR3C2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1240179-A2 3-METHYLENE STEROID DERIVATIVES FOR THE TREATMENT OF AUTOIMMUNE DISEASES Akzo Nobel N.V. (NL) 2002-09-18 — — EP claimed
WO-2001040253-A2 3-METHYLENE STEROID DERIVATIVE FOR THE TREATMENT OF AUTOIMMUNE DISEASES AKZO NOBEL N.V. (NL) 2001-06-07 — — WO claimed
EP-1240179-A2 3-METHYLENE STEROID DERIVATIVES FOR THE TREATMENT OF AUTOIMMUNE DISEASES Akzo Nobel N.V. (NL) 2002-09-18 — — EP disclosed
WO-2001040253-A2 3-METHYLENE STEROID DERIVATIVE FOR THE TREATMENT OF AUTOIMMUNE DISEASES AKZO NOBEL N.V. (NL) 2001-06-07 — — WO disclosed
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