SCHEMBL9623141

SCHEMBL9623141

C[C@]12CCC(=O)C=C1CCC1C2[C@@H](O)C[C@@]2(C)C1CC[C@]2(O)[C@H](Cl)[Si](C)(C)OC#N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 11/20 0.57
LMNA P02545 2/20 0.57
NR3C1 P04150 4/20 0.55
NR3C2 P08235 4/20 0.55
PGR P06401 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
CYP2C19 P33261 2/20 0.55
HSD17B10 Q99714 2/20 0.55
SERPINA6 P08185 2/20 0.55
CYP3A4 P08684 2/20 0.55
NFKB1 P19838 2/20 0.55
MAPT P10636 2/20 0.55
KMT2A Q03164 2/20 0.55
SHBG P04278 1/20 0.55
AR P10275 1/20 0.53
CHRM1 P11229 1/20 0.53
PMP22 Q01453 1/20 0.49
TSHR P16473 1/20 0.49
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48

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 0.87 SHBG (0.58) HIF1ALMNANR3C1NR3C2PGR
SCHEMBL9623681 0.86 CYP3A4 (0.59) HIF1ALMNANR3C1NR3C2PGR
SCHEMBL9623278 0.85 HIF1A (0.41) HIF1ALMNANR3C1NR3C2PGR
SCHEMBL9623647 0.84 NR3C1 (0.56) HIF1ALMNANR3C1NR3C2PGR
SCHEMBL18878439 0.81 HIF1A (0.71) HIF1ALMNANR3C1NR3C2PGR
SCHEMBL15920488 0.81 HIF1A (0.67) HIF1ALMNANR3C1NR3C2PGR
SCHEMBL15904751 0.80 HIF1A (0.68) HIF1ALMNANR3C1NR3C2PGR
SCHEMBL14523062 0.80 HIF1A (0.68) HIF1ALMNANR3C1NR3C2PGR
SCHEMBL21973842 0.80 HIF1A (0.68) HIF1ALMNANR3C1NR3C2PGR
SCHEMBL15920472 0.80 HIF1A (0.68) HIF1ALMNANR3C1NR3C2PGR

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 5 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 claimed
US-4977255-A Steroidal 17α-silyl ethers and process to corticoids and progesterones THE UPJOHN COMPANY (US) 1990-12-11 US claimed
EP-0334875-A1 STEROIDAL 17$g(a)-SILYL ETHERS AND PROCESS TO CORTICOIDS AND PROGGESTERONES THE UPJOHN COMPANY (US) 1989-10-04 EP claimed
EP-0268400-A1 Steroidal 17alpha-silyl ethers and process to corticoids and progesterones THE UPJOHN COMPANY (US) 1988-05-25 EP claimed
WO-1988003534-A1 STEROIDAL 17alpha-SILYL ETHERS AND PROCESS TO CORTICOIDS AND PROGGESTERONES THE UPJOHN COMPANY (US) 1988-05-19 WO claimed