SCHEMBL9521233

SCHEMBL9521233

CC(=O)OCC(=O)C1=CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@]34OC4C[C@]12C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.69
SMN1; SMN2 Q16637 2/20 0.69
KDM4E B2RXH2 1/20 0.51
HIF1A Q16665 8/20 0.44
PGR P06401 5/20 0.44
CYP3A4 P08684 4/20 0.44
ALDH1A1 P00352 2/20 0.44
POLB P06746 1/20 0.44
AR P10275 1/20 0.44
NR3C1 P04150 4/20 0.44
CNR1 P21554 2/20 0.44
USP2 O75604 2/20 0.44
KCNH2 Q12809 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MAPT P10636 1/20 0.44
CYP2C9 P11712 1/20 0.43
TBXA2R P21731 1/20 0.43
CYP19A1 P11511 1/20 0.39
FNTA P49354 1/20 0.39
FNTB P49356 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
SCHEMBL9521229 1.00 LMNA (0.69) LMNASMN1; SMN2KDM4EHIF1APGR
SCHEMBL19762243 1.00 LMNA (0.69) LMNASMN1; SMN2KDM4EHIF1APGR
SCHEMBL29043217 1.00 LMNA (0.69) LMNASMN1; SMN2KDM4EHIF1APGR
SCHEMBL20821236 0.90 LMNA (0.55) LMNASMN1; SMN2KDM4EHIF1APGR
SCHEMBL9717210 0.88 KDM4E (0.60) LMNASMN1; SMN2KDM4EHIF1APGR
SCHEMBL9717206 0.88 KDM4E (0.60) LMNASMN1; SMN2KDM4EHIF1APGR
SCHEMBL21091789 0.88 LMNA (0.54) LMNASMN1; SMN2KDM4EHIF1APGR
SCHEMBL9737156 0.83 LMNA (0.52) LMNASMN1; SMN2HIF1APGRCYP3A4
SCHEMBL9737165 0.83 LMNA (0.52) LMNASMN1; SMN2HIF1APGRCYP3A4
SCHEMBL9717248 0.83 LMNA (0.54) LMNASMN1; SMN2KDM4EHIF1APGR

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 16 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 claimed
EP-0308412-B1 16$g(a)-METHYLATION PROCESS THE UPJOHN COMPANY (US) 1992-03-18 EP claimed
US-4929395-A 16α-methylation process THE UPJOHN COMPANY (US) 1990-05-29 US claimed
EP-0278319-A1 9,11-Epoxy-21-hydroxypregnane derivatives THE UPJOHN COMPANY (US) 1988-08-17 EP claimed
EP-0165037-A2 16 alpha-methyl steroids and their preparation THE UPJOHN COMPANY (US) 1985-12-18 EP claimed
EP-0474668-B1 CONVERSION OF DELTA 16-STEROID TO A DELTA 17(20)-20-SILYL ETHER THE UPJOHN COMPANY (US) 1993-08-25 EP disclosed
EP-0278319-B1 9,11-EPOXY-21-HYDROXYPREGNANE DERIVATIVES THE UPJOHN COMPANY (US) 1992-10-07 EP disclosed
EP-0308412-B1 16$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
WO-1990015068-A1 CONVERSION OF DELTA16-STEROID TO A DELTA17(20)-20-SILYL ETHER THE UPJOHN COMPANY (US) 1990-12-13 WO 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
EP-0278319-A1 9,11-Epoxy-21-hydroxypregnane derivatives THE UPJOHN COMPANY (US) 1988-08-17 EP 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