SCHEMBL7547206

SCHEMBL7547206

COC(=O)Cc1cc(Br)c(Oc2cc(C3CCCC3)c(OC)cc2C(=O)c2cccc(C)c2)c(Br)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.59
DRD4 P21917 2/20 0.39
DRD2 P14416 1/20 0.39
PTGDR2 Q9Y5Y4 2/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA4 P22748 2/20 0.35
CA6 P23280 2/20 0.35
ABL1 P00519 1/20 0.35
RIN1 Q13671 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
NPC1 O15118 3/20 0.34
RAB9A P51151 2/20 0.34
PTGDR Q13258 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL7254157 0.86 NR3C1 (0.57) NR3C1DRD4DRD2L3MBTL1ALDH1A1
SCHEMBL7252247 0.85 NR3C1 (0.66) NR3C1ABL1RIN1L3MBTL1ALDH1A1
SCHEMBL7252910 0.84 NR3C1 (0.63) NR3C1ALDH1A1KDM4EGAANPC1
SCHEMBL7256747 0.83 NR3C1 (0.62) NR3C1ALDH1A1KDM4EGAANPC1
SCHEMBL5630623 0.82 NR3C1 (0.85) NR3C1ABL1RIN1ALDH1A1KDM4E
SCHEMBL7251172 0.78 NR3C1 (0.67) NR3C1L3MBTL1
SCHEMBL7257439 0.77 NR3C1 (0.73) NR3C1ALDH1A1KDM4EGAAMEN1
SCHEMBL5630342 0.77 NR3C1 (0.70) NR3C1
SCHEMBL7254627 0.77 NR3C1 (0.78) NR3C1ALDH1A1KDM4EGAAMEN1
SCHEMBL7549312 0.76 PTGDR2 (0.49) PTGDR2CA1CA2CA4CA6

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
WO-2002044120-A1 COMPOUNDS ACTIVE AT THE GLUCOCORTICOID RECEPTOR III KARO BIO AB (SE) 2002-06-06 WO disclosed