SCHEMBL7980778

SCHEMBL7980778

C[C@@](Cc1ccc(OS(=O)(=O)F)cc1)(NS(=O)(=O)c1ccc2ccccc2c1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
MMP13 P45452 2/20 0.43
MMP1 P03956 1/20 0.43
MMP9 P14780 1/20 0.43
MMP2 P08253 1/20 0.42
ACACB O00763 1/20 0.42
RAPGEF3 O95398 1/20 0.41
ALDH1A1 P00352 4/20 0.41
KAT6A Q92794 5/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PGR P06401 1/20 0.40
SLC16A3 O15427 1/20 0.39
NPY5R Q15761 1/20 0.39
F2 P00734 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
SCHEMBL7983826 0.92 POLB (0.44) POLBMMP13MMP1MMP9MMP2
SCHEMBL7984108 0.86 KAT6A (0.50) POLBACACBALDH1A1KAT6AL3MBTL1
SCHEMBL7984111 0.86 KAT6A (0.50) POLBACACBALDH1A1KAT6AL3MBTL1
SCHEMBL7983907 0.82 KAT6A (0.49) POLBALDH1A1KAT6AL3MBTL1KMT2A
SCHEMBL7983911 0.82 KAT6A (0.49) POLBALDH1A1KAT6AL3MBTL1KMT2A
SCHEMBL7982468 0.80 EGFR (0.43) MMP13MMP1MMP9ALDH1A1L3MBTL1
SCHEMBL7981503 0.76 EGFR (0.43) MMP13MMP1MMP9MMP2ALDH1A1
SCHEMBL7983169 0.73 KAT6A (0.37) POLBACACBRAPGEF3ALDH1A1KAT6A
SCHEMBL7980773 0.73 F2 (0.55) POLBKMT2AF2
SCHEMBL14675766 0.73 L3MBTL1 (0.57) ALDH1A1KAT6AL3MBTL1KMT2ALMNA

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
US-6284912-B1 Process for synthesizing para-and/or meta-substituted cyanophenyalanine derivatives LG CHEMICAL, LTD. (KR) 2001-09-04 US claimed