SCHEMBL28094060

SCHEMBL28094060

O=C(CO)c1cccc(C23CC4CC(CC(C4)C2)C3)c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 1/20 0.50
STS P08842 1/20 0.50
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
GFER P55789 1/20 0.46
HIF1A Q16665 6/20 0.44
EPAS1 Q99814 3/20 0.44
FAAH O00519 2/20 0.41
RAB9A P51151 1/20 0.41
NPC1 O15118 1/20 0.41
P2RX7 Q99572 2/20 0.41
FFAR4 Q5NUL3 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
MDH1 P40925 1/20 0.39
MDH2 P40926 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 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
SCHEMBL9124033 0.84 SERPINE1 (0.55) SERPINE1MEN1KMT2APOLBGAA
SCHEMBL422675 0.84 SERPINE1 (0.58) SERPINE1STSMEN1KMT2APOLB
SCHEMBL28197968 0.83 HIF1A (0.55) SERPINE1MEN1KMT2APOLBGAA
SCHEMBL2388331 0.82 HIF1A (0.49) SERPINE1MEN1KMT2APOLBGAA
SCHEMBL28094061 0.80 STS (0.46) SERPINE1STSMEN1KMT2APOLB
SCHEMBL9126429 0.79 HIF1A (0.60) SERPINE1MEN1KMT2AHIF1AEPAS1
SCHEMBL7501343 0.77 HIF1A (0.48) SERPINE1MEN1KMT2AHIF1AEPAS1
SCHEMBL27847928 0.77 MEN1 (0.59) SERPINE1MEN1KMT2APOLBGAA
SCHEMBL2747091 0.75 SERPINE1 (0.50) SERPINE1STSMEN1KMT2AHIF1A
SCHEMBL28094159 0.75 FAAH (0.53) STSMEN1KMT2AHIF1AEPAS1

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
CN-106220600-A Flavone derivatives and its production and use 厦门大学 2016-12-14 CN claimed