SCHEMBL9848020

SCHEMBL9848020

N[C@@H](Cc1c(Cl)cc(O)cc1CF)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.45
HSD17B10 Q99714 4/20 0.45
USP2 O75604 3/20 0.45
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 3/20 0.45
KMT2A Q03164 3/20 0.45
HIF1A Q16665 2/20 0.45
RECQL P46063 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
CYP3A4 P08684 2/20 0.45
NFKB1 P19838 2/20 0.45
LMNA P02545 2/20 0.45
MAPT P10636 2/20 0.45
BLM P54132 2/20 0.45
PMP22 Q01453 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
PKM P14618 2/20 0.45
CYP2C9 P11712 2/20 0.45
MEN1 O00255 2/20 0.45
HPGD P15428 2/20 0.45

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
SCHEMBL5327701 0.87 SLC7A5 (0.50) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL5327704 0.87 SLC7A5 (0.50) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL9847981 0.83 USP2 (0.50) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL9847956 0.81 MEN1 (0.42) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL5323962 0.76 MAPT (0.51) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL5323956 0.76 MAPT (0.51) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL5564602 0.75 KDM4E (0.54) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL9848007 0.75 KDM4E (0.54) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL5565921 0.75 KDM4E (0.54) ALOX15HSD17B10USP2KDM4EALDH1A1
SCHEMBL5803421 0.74 SLC7A5 (0.50) ALOX15HSD17B10USP2KDM4EALDH1A1

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
EP-0451422-A1 Pharmaceutically active fluoromethyltyrosine compounds MERRELL DOW PHARMACEUTICALS INC. (US) 1991-10-16 EP disclosed