SCHEMBL9623575

SCHEMBL9623575

CC(C)O[Si](OC#N)(OC(C)C)[C@@H](Cl)[C@@]1(O)CCC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@@]21C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 6/20 0.54
NR3C1 P04150 3/20 0.54
ALDH1A1 P00352 3/20 0.54
PGR P06401 2/20 0.54
ADRA1A P35348 1/20 0.54
HTR2B P41595 1/20 0.54
SMN1; SMN2 Q16637 6/20 0.52
LMNA P02545 5/20 0.52
CYP2C19 P33261 3/20 0.52
TSHR P16473 3/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
HIF1A Q16665 2/20 0.52
THRB P10828 1/20 0.52
ESR1 P03372 1/20 0.52
AR P10275 1/20 0.52
CYP17A1 P05093 5/20 0.51
SERPINA6 P08185 5/20 0.51
BLM P54132 4/20 0.51
MAPT P10636 2/20 0.51

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
SCHEMBL9623247 0.88 SHBG (0.58) SHBGNR3C1ALDH1A1PGRADRA1A
SCHEMBL9623157 0.81 SHBG (0.58) SHBGNR3C1ALDH1A1PGRADRA1A
SCHEMBL9623714 0.79 NR3C1 (0.50) SHBGNR3C1ALDH1A1PGRADRA1A
SCHEMBL20960006 0.78 SHBG (0.74) SHBGNR3C1ALDH1A1PGRADRA1A
SCHEMBL18884076 0.78 SHBG (0.74) SHBGNR3C1ALDH1A1PGRADRA1A
SCHEMBL24437558 0.77 SHBG (0.72) SHBGNR3C1ALDH1A1PGRADRA1A
SCHEMBL20457501 0.77 SHBG (0.72) SHBGNR3C1ALDH1A1PGRADRA1A
SCHEMBL20781184 0.77 SHBG (0.72) SHBGNR3C1ALDH1A1PGRADRA1A
SCHEMBL17776496 0.77 SHBG (0.72) SHBGNR3C1ALDH1A1PGRADRA1A
SCHEMBL24437560 0.77 SHBG (0.72) SHBGNR3C1ALDH1A1PGRADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0268400-B1 STEROIDAL 17ALPHA-SILYL ETHERS AND PROCESS TO CORTICOIDS AND PROGESTERONES THE UPJOHN COMPANY (US) 1992-04-29 EP disclosed
US-4977255-A Steroidal 17α-silyl ethers and process to corticoids and progesterones THE UPJOHN COMPANY (US) 1990-12-11 US disclosed
US-4921638-A 17β-cyano-9α,17α-dihydroxyandrost-4-en-3-one THE UPJOHN COMPANY (US) 1990-05-01 US disclosed
EP-0334875-A1 STEROIDAL 17$g(a)-SILYL ETHERS AND PROCESS TO CORTICOIDS AND PROGGESTERONES THE UPJOHN COMPANY (US) 1989-10-04 EP disclosed
EP-0268400-A1 Steroidal 17alpha-silyl ethers and process to corticoids and progesterones THE UPJOHN COMPANY (US) 1988-05-25 EP disclosed
WO-1988003534-A1 STEROIDAL 17alpha-SILYL ETHERS AND PROCESS TO CORTICOIDS AND PROGGESTERONES THE UPJOHN COMPANY (US) 1988-05-19 WO disclosed