SCHEMBL9851430

SCHEMBL9851430

N[C@@H](Cc1c(F)cc(O)cc1C(F)F)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.45
ALOX15 P16050 3/20 0.45
HSD17B10 Q99714 3/20 0.45
KDM4E B2RXH2 3/20 0.45
HIF1A Q16665 2/20 0.45
RECQL P46063 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
PKM P14618 2/20 0.45
CYP3A4 P08684 2/20 0.45
NFKB1 P19838 2/20 0.45
ALDH1A1 P00352 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
KMT2A Q03164 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
RGS12 O14924 1/20 0.45
CYP2C9 P11712 1/20 0.45
CASP1 P29466 1/20 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
SCHEMBL296983 0.87 USP2 (0.53) USP2ALOX15HSD17B10KDM4EHIF1A
SCHEMBL296982 0.87 USP2 (0.53) USP2ALOX15HSD17B10KDM4EHIF1A
SCHEMBL9847956 0.84 MEN1 (0.42) USP2ALOX15HSD17B10KDM4EHIF1A
SCHEMBL9847981 0.80 USP2 (0.50) USP2ALOX15HSD17B10KDM4EHIF1A
SCHEMBL29141540 0.80 USP2 (0.46) USP2ALOX15HSD17B10KDM4EHIF1A
SCHEMBL5672304 0.75 USP2 (0.50) USP2ALOX15HSD17B10KDM4EHIF1A
SCHEMBL28551296 0.75 USP2 (0.50) USP2ALOX15HSD17B10KDM4EHIF1A
SCHEMBL5285947 0.75 USP2 (0.50) USP2ALOX15HSD17B10KDM4EHIF1A
SCHEMBL5672308 0.75 USP2 (0.50) USP2ALOX15HSD17B10KDM4EHIF1A
SCHEMBL7280604 0.75 USP2 (0.50) USP2ALOX15HSD17B10KDM4EHIF1A

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