SCHEMBL3452767

SCHEMBL3452767

CCCCCCOC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3[C@@H](C)C[C@]12C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 5/20 0.62
▸ MAPT P10636 5/20 0.57
▸ LMNA P02545 5/20 0.57
▸ PGR P06401 4/20 0.47
▸ SERPINA6 P08185 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ SLC22A1 O15245 1/20 0.42
▸ SHBG P04278 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ MCL1 Q07820 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ CYP3A4 P08684 3/20 0.37
▸ NR3C1 P04150 2/20 0.37
▸ NR1I2 O75469 1/20 0.37
▸ CYP17A1 P05093 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ CYP2C19 P33261 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
SCHEMBL3453723 1.00 AR (0.62) ARMAPTLMNAPGRSERPINA6
SCHEMBL3453150 1.00 AR (0.62) ARMAPTLMNAPGRSERPINA6
SCHEMBL3453303 1.00 AR (0.62) ARMAPTLMNAPGRSERPINA6
SCHEMBL25863611 1.00 AR (0.62) ARMAPTLMNAPGRSERPINA6
SCHEMBL24102429 0.99 AR (0.61) ARMAPTLMNAPGRSERPINA6
SCHEMBL3453254 0.91 MAPT (0.56) ARMAPTLMNAPGRSERPINA6
SCHEMBL3453325 0.91 MAPT (0.56) ARMAPTLMNAPGRSERPINA6
SCHEMBL3453522 0.91 MAPT (0.56) ARMAPTLMNAPGRSERPINA6
SCHEMBL3453196 0.91 MAPT (0.56) ARMAPTLMNAPGRSERPINA6
SCHEMBL3453717 0.91 MAPT (0.56) ARMAPTLMNAPGRSERPINA6

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
US-7820642-B2 Nandrolone 17β-carbonates THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2010-10-26 — — US claimed
EP-1846434-B1 NANDROLONE 17ß-CARBONATES US GOV HEALTH & HUMAN SERV (US) 2009-03-25 — — EP claimed
US-7820642-B2 Nandrolone 17β-carbonates THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2010-10-26 — — US disclosed
EP-1846434-B1 NANDROLONE 17ß-CARBONATES US GOV HEALTH & HUMAN SERV (US) 2009-03-25 — — EP disclosed
Send feedback