SCHEMBL28869415

SCHEMBL28869415

COC(=O)c1ccc(Oc2ccccc2F)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.47
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 1/20 0.46
PARP10 Q53GL7 1/20 0.46
P2RY14 Q15391 1/20 0.46
PYGL P06737 1/20 0.44
MGLL Q99685 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPT P10636 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
NFKB1 P19838 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CARM1 Q86X55 2/20 0.43
PRMT6 Q96LA8 2/20 0.43

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
SCHEMBL28275272 0.85 LMNA (0.51) PARP10P2RY14HTTRAB9ACXCL8
SCHEMBL27018576 0.82 BRD4 (0.45) NOTUMALDH1A1KMT2APYGLL3MBTL1
SCHEMBL14028926 0.82 MGLL (0.46) ALDH1A1KMT2AMGLLL3MBTL1MAPT
SCHEMBL26563554 0.81 CARM1 (0.50) NOTUMALDH1A1KMT2AMGLLL3MBTL1
SCHEMBL8070206 0.81 TTR (0.55) NOTUMALDH1A1KMT2AMGLLL3MBTL1
SCHEMBL28276502 0.79 PARP10 (0.67) ALDH1A1KMT2APARP10L3MBTL1MAPT
SCHEMBL23249875 0.77 BRD4 (0.43) ALDH1A1KMT2APYGLL3MBTL1MAPT
SCHEMBL29890412 0.77 BRD4 (0.43) ALDH1A1KMT2APYGLL3MBTL1MAPT
SCHEMBL12388479 0.77 PDK2 (0.50) NOTUMALDH1A1KMT2APYGLL3MBTL1
SCHEMBL2291665 0.76 CHEK1 (0.60) ALDH1A1KMT2AP2RY14NPC1HTT

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-109311860-A For treating or preventing the Xanthone derivative of hepatitis type B virus disease 豪夫迈·罗氏有限公司 2019-02-05 CN disclosed