SCHEMBL9717252

SCHEMBL9717252

CC(=O)OCC(=O)C1=CC[C@H]2[C@@H]3CC(F)C4=CC(=O)C=C[C@]4(C)[C@]34OC4C[C@]12C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
HIF1A Q16665 8/20 0.48
PGR P06401 7/20 0.48
AR P10275 6/20 0.48
NR3C1 P04150 4/20 0.48
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP3A4 P08684 4/20 0.45
CYP1A2 P05177 1/20 0.45
NPSR1 Q6W5P4 1/20 0.42
MAPT P10636 2/20 0.39
ABCB11 O95342 2/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPK1 P28482 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
NR1I2 O75469 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
SCHEMBL9717248 1.00 LMNA (0.54) LMNASMN1; SMN2HIF1APGRAR
SCHEMBL24622441 0.84 HIF1A (0.61) LMNASMN1; SMN2HIF1APGRAR
SCHEMBL6523590 0.84 HIF1A (0.61) LMNASMN1; SMN2HIF1APGRAR
SCHEMBL2300385 0.84 HIF1A (0.61) LMNASMN1; SMN2HIF1APGRAR
SCHEMBL29043217 0.83 LMNA (0.69) LMNASMN1; SMN2HIF1APGRAR
SCHEMBL9521229 0.83 LMNA (0.69) LMNASMN1; SMN2HIF1APGRAR
SCHEMBL9521233 0.83 LMNA (0.69) LMNASMN1; SMN2HIF1APGRAR
SCHEMBL19762243 0.83 LMNA (0.69) LMNASMN1; SMN2HIF1APGRAR
SCHEMBL19931499 0.82 LMNA (0.56) LMNASMN1; SMN2HIF1APGRAR
SCHEMBL11321836 0.79 HIF1A (0.49) LMNASMN1; SMN2HIF1APGRAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0278319-B1 9,11-EPOXY-21-HYDROXYPREGNANE DERIVATIVES THE UPJOHN COMPANY (US) 1992-10-07 EP disclosed
EP-0308412-B1 16$g(a)-METHYLATION PROCESS THE UPJOHN COMPANY (US) 1992-03-18 EP disclosed
US-4990612-A 16α-methylation process THE UPJOHN COMPANY (US) 1991-02-05 US disclosed
EP-0165037-B1 16 ALPHA-METHYL STEROIDS AND THEIR PREPARATION THE UPJOHN COMPANY (US) 1990-09-19 EP disclosed
US-4929395-A 16α-methylation process THE UPJOHN COMPANY (US) 1990-05-29 US disclosed
US-4891426-A EPOXIDATION WITH PERACID THE UPJOHN COMPANY (US) 1990-01-02 US disclosed
US-4704455-A 16α-methylatedΔ17(20)-corticoids THE UPJOHN COMPANY (US) 1987-11-03 US disclosed
EP-0165037-A2 16 alpha-methyl steroids and their preparation THE UPJOHN COMPANY (US) 1985-12-18 EP disclosed