SCHEMBL9627974

SCHEMBL9627974

CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)CC[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 8/20 0.57
HIF1A Q16665 6/20 0.57
LMNA P02545 4/20 0.57
PGR P06401 3/20 0.57
CYP3A4 P08684 3/20 0.57
CYP2C9 P11712 2/20 0.57
NR1I2 O75469 1/20 0.57
GAA P10253 1/20 0.57
HTT P42858 1/20 0.57
HRH1 P35367 1/20 0.55
AR P10275 2/20 0.53
HSD17B10 Q99714 2/20 0.53
TSHR P16473 1/20 0.51
ALDH1A1 P00352 1/20 0.51
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
CYP2C19 P33261 1/20 0.48
KMT2A Q03164 1/20 0.48
FNTA P49354 1/20 0.47
FNTB P49356 1/20 0.47

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
SCHEMBL9627979 1.00 NR3C1 (0.57) NR3C1HIF1ALMNAPGRCYP3A4
SCHEMBL13069286 0.90 NR3C1 (0.67) NR3C1HIF1ALMNAPGRCYP3A4
SCHEMBL13069231 0.90 NR3C1 (0.67) NR3C1HIF1ALMNAPGRCYP3A4
SCHEMBL11854050 0.90 NR3C1 (0.72) NR3C1HIF1APGRCYP3A4HRH1
SCHEMBL11854066 0.90 NR3C1 (0.72) NR3C1HIF1APGRCYP3A4HRH1
SCHEMBL13069234 0.89 NR3C1 (0.55) NR3C1HIF1ALMNAPGRCYP3A4
SCHEMBL4273345 0.83 AR (0.54) NR3C1HIF1ALMNAPGRCYP3A4
SCHEMBL4267312 0.83 AR (0.54) NR3C1HIF1ALMNAPGRCYP3A4
SCHEMBL4267316 0.83 AR (0.54) NR3C1HIF1ALMNAPGRCYP3A4
SCHEMBL21231580 0.83 NR3C1 (0.80) NR3C1HIF1ALMNAPGRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0276393-B1 PROCESS FOR THE PREPARATION OF 6-ALPHA, 9-ALPHA-DIFLUORO-11-BETA-17-ALPHA-DIHYDROXY-16-ALPHA-METHYL-PREGN-4-ENE-3,20-DIONE AND ITS DERIVATIVES SCHERING AKTIENGESELLSCHAFT (DE) 1992-03-04 EP claimed
EP-0276393-B1 PROCESS FOR THE PREPARATION OF 6-ALPHA, 9-ALPHA-DIFLUORO-11-BETA-17-ALPHA-DIHYDROXY-16-ALPHA-METHYL-PREGN-4-ENE-3,20-DIONE AND ITS DERIVATIVES SCHERING AKTIENGESELLSCHAFT (DE) 1992-03-04 EP disclosed