SCHEMBL7143244

SCHEMBL7143244

CC1C=C2[C@@H]3C(C)CC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]2(C)C1O

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SHBG P04278 2/20 0.70
▸ AR P10275 5/20 0.53
▸ SERPINA6 P08185 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ SLC22A1 O15245 1/20 0.45
▸ THRB P10828 1/20 0.45
▸ CYP19A1 P11511 2/20 0.44
▸ PGR P06401 5/20 0.43
▸ NR3C2 P08235 2/20 0.43
▸ LMNA P02545 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ HIF1A Q16665 1/20 0.39

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
SCHEMBL6568987 1.00 SHBG (0.70) SHBGARSERPINA6ALDH1A1SLC22A1
SCHEMBL7136152 0.85 CYP19A1 (0.54) SHBGARSERPINA6ALDH1A1SLC22A1
SCHEMBL6570207 0.85 CYP19A1 (0.54) SHBGARSERPINA6ALDH1A1SLC22A1
SCHEMBL6570222 0.85 CYP19A1 (0.54) SHBGARSERPINA6ALDH1A1SLC22A1
SCHEMBL6711427 0.82 SHBG (1.00) SHBGARSERPINA6ALDH1A1SLC22A1
SCHEMBL6569593 0.78 SHBG (0.65) SHBGARSERPINA6ALDH1A1SLC22A1
SCHEMBL3875239 0.78 SHBG (0.65) SHBGARSERPINA6ALDH1A1SLC22A1
SCHEMBL3875240 0.78 SHBG (0.65) SHBGARSERPINA6ALDH1A1SLC22A1
SCHEMBL7141591 0.78 SHBG (0.65) SHBGARSERPINA6ALDH1A1SLC22A1
SCHEMBL6570514 0.75 SHBG (0.62) SHBGARSERPINA6ALDH1A1SLC22A1

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-1343804-A1 14(15)-UNSATURATED 15- AND/OR 16- SUBSTITUTED ANDROGENS WITH MIXED ANDROGEN-PROGESTATIONAL PROFILE Akzo Nobel N.V. (NL) 2003-09-17 — — EP claimed
WO-2002048169-A1 14(15)-UNSATURATED 15- AND/OR 16- SUBSTITUTED ANDROGENS WITH MIXED ANDROGEN-PROGESTATIONAL PROFILE AKZO NOBEL N.V. (NL) 2002-06-20 — — WO claimed
EP-1343804-A1 14(15)-UNSATURATED 15- AND/OR 16- SUBSTITUTED ANDROGENS WITH MIXED ANDROGEN-PROGESTATIONAL PROFILE Akzo Nobel N.V. (NL) 2003-09-17 — — EP disclosed
WO-2002048169-A1 14(15)-UNSATURATED 15- AND/OR 16- SUBSTITUTED ANDROGENS WITH MIXED ANDROGEN-PROGESTATIONAL PROFILE AKZO NOBEL N.V. (NL) 2002-06-20 — — WO disclosed
Send feedback