SCHEMBL7795441

SCHEMBL7795441

C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]3[C@@H]4CC[C@@H]4[C@@](O)(CCOC(=O)O)[C@@]3(C)CC[C@@H]12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.55
MAPT P10636 1/20 0.55
CYP19A1 P11511 7/20 0.49
HIF1A Q16665 4/20 0.49
PGR P06401 3/20 0.49
HSD17B10 Q99714 5/20 0.48
CYP3A4 P08684 2/20 0.48
NR3C1 P04150 2/20 0.48
ABCB11 O95342 1/20 0.48
TNF P01375 1/20 0.48
IL6 P05231 1/20 0.48
SERPINA6 P08185 1/20 0.48
NR3C2 P08235 1/20 0.48
AR P10275 1/20 0.48
GLUL P15104 1/20 0.48
ADAM17 P78536 1/20 0.48
GPBAR1 Q8TDU6 1/20 0.48
CYP2C19 P33261 1/20 0.48
KMT2A Q03164 2/20 0.47
MEN1 O00255 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
SCHEMBL6706306 0.88 LMNA (0.58) LMNAMAPTCYP19A1HIF1APGR
SCHEMBL10957587 0.86 LMNA (0.52) LMNAMAPTCYP19A1HIF1APGR
SCHEMBL10959603 0.85 LMNA (0.55) LMNAMAPTCYP19A1HIF1APGR
SCHEMBL11325913 0.85 LMNA (0.59) LMNAMAPTCYP19A1HIF1APGR
SCHEMBL10960995 0.84 LMNA (0.50) LMNAMAPTCYP19A1HIF1APGR
Potassium Ion SCHEMBL10962185 0.84 LMNA (0.56) LMNAMAPTCYP19A1HIF1APGR
SCHEMBL7793950 0.82 SHBG (0.54) LMNAMAPTHIF1APGRHSD17B10
SCHEMBL16564354 0.76 PGR (0.51) LMNAMAPTCYP19A1HIF1APGR
SCHEMBL7793500 0.75 SHBG (0.42) LMNAMAPTCYP19A1HIF1APGR
SCHEMBL10380227 0.73 LMNA (0.74) LMNAMAPTCYP19A1HIF1APGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0863760-B1 USE OF ANTIMINERALOCORTICOID COMPOUNDS AGAINST DRUG WITHDRAWAL SYNDROME AVENTIS PHARMA SA (FR) 2001-12-05 EP claimed