SCHEMBL8203795

SCHEMBL8203795

C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)CC[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
KCNH2 Q12809 1/20 0.44
ALDH1A1 P00352 2/20 0.41
TSHR P16473 1/20 0.41
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
NR3C1 P04150 4/20 0.39
CYP19A1 P11511 6/20 0.38
AR P10275 4/20 0.37
HIF1A Q16665 3/20 0.34
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
PGR P06401 3/20 0.33
ABCB11 O95342 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL9627248 0.92 ALDH1A1 (0.50) NFKB1NFKB2RELAKCNH2ALDH1A1
SCHEMBL10419014 0.89 NFKB1 (0.54) NFKB1NFKB2RELAKCNH2ALDH1A1
SCHEMBL8207710 0.89 NFKB1 (0.54) NFKB1NFKB2RELAKCNH2ALDH1A1
SCHEMBL7565596 0.89 NFKB1 (0.54) NFKB1NFKB2RELAKCNH2ALDH1A1
SCHEMBL9619163 0.89 NFKB1 (0.54) NFKB1NFKB2RELAKCNH2ALDH1A1
SCHEMBL8192700 0.89 NFKB1 (0.54) NFKB1NFKB2RELAKCNH2ALDH1A1
SCHEMBL8470203 0.89 NFKB1 (0.46) NFKB1NFKB2RELAKCNH2ALDH1A1
SCHEMBL8470202 0.89 NFKB1 (0.46) NFKB1NFKB2RELAKCNH2ALDH1A1
SCHEMBL3083179 0.89 NFKB1 (0.54) NFKB1NFKB2RELAKCNH2ALDH1A1
Methyl Alcohol SCHEMBL9756756 0.89 NFKB1 (0.54) NFKB1NFKB2RELAKCNH2ALDH1A1

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-0533703-B1 Use of steroids for the inhibition of angiogenesis ALCON LAB INC (US) 2000-03-15 EP disclosed
US-5972922-A Steroids which inhibit angiogenesis ALCON LABORATORIES, INC. (US) 1999-10-26 US disclosed