SCHEMBL5511548

SCHEMBL5511548

Nc1ccc(F)c2c(O)c(F)ccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 2/20 0.35
KAT2B Q92831 2/20 0.35
KAT8 Q9H7Z6 2/20 0.35
HDAC3 O15379 1/20 0.35
IDO1 P14902 1/20 0.35
NCOR2 Q9Y618 1/20 0.35
ALDH1A1 P00352 4/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
HPGD P15428 2/20 0.32
ERN1 O75460 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
ALOX15 P16050 2/20 0.31

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
SCHEMBL5509893 0.78 HSD17B1 (0.35) EP300KAT2BKAT8HDAC3IDO1
SCHEMBL27525538 0.77 ALDH1A1 (0.36) ALDH1A1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL5506962 0.77 ALDH1A1 (0.36) ALDH1A1CRHBPCRHR2KEAP1NFE2L2
SCHEMBL5506933 0.77 TSHR (0.41) IDO1HPGDERN1KDM4EMAPT
SCHEMBL22134195 0.74 ALDH1A1 (0.40) EP300KAT2BKAT8HDAC3IDO1
SCHEMBL5513042 0.72 ALDH1A1 (0.54) EP300KAT2BKAT8HDAC3IDO1
SCHEMBL11589547 0.72 ALDH1A1 (0.39) EP300KAT2BKAT8HDAC3IDO1
SCHEMBL30739954 0.72 ALDH1A1 (0.39) EP300KAT2BKAT8HDAC3IDO1
SCHEMBL5508816 0.71 ALDH1A1 (0.52) EP300KAT2BKAT8HDAC3IDO1
Hydrochloric Acid SCHEMBL20498005 0.71 ALDH1A1 (0.52) EP300KAT2BKAT8HDAC3IDO1

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
US-7208559-B2 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2007-04-24 US disclosed
US-20060135712-A1 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2006-06-22 US disclosed