SCHEMBL7325564

SCHEMBL7325564

COc1ccc(S(=O)(=O)Nc2c(C)cc(C)cc2C(=O)O)c(Cc2cccc(Br)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.49
FFAR4 Q5NUL3 3/20 0.44
MMP1 P03956 3/20 0.42
MMP13 P45452 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
GAA P10253 2/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA3 P34903 1/20 0.42
ACLY P53396 1/20 0.40
POLB P06746 2/20 0.39
MMP9 P14780 2/20 0.39
PTGER4 P35408 1/20 0.38
PTGER3 P43115 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ADAM17 P78536 1/20 0.38
MTNR1A P48039 1/20 0.38

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
SCHEMBL7311131 0.93 FFAR4 (0.44) METAP2FFAR4MMP1MMP13MEN1
SCHEMBL7322650 0.91 METAP2 (0.58) METAP2FFAR4MMP1MMP13MEN1
SCHEMBL7318667 0.87 METAP2 (0.45) METAP2MMP1MMP13MEN1KMT2A
SCHEMBL7315641 0.85 METAP2 (0.54) METAP2FFAR4MMP1MMP13MEN1
SCHEMBL7317403 0.84 METAP2 (0.48) METAP2FFAR4MMP1MMP13MEN1
SCHEMBL7317721 0.83 METAP2 (0.57) METAP2FFAR4MEN1KMT2AGAA
SCHEMBL7313454 0.83 ACLY (0.51) METAP2FFAR4MEN1KMT2AGAA
SCHEMBL7315387 0.82 FFAR4 (0.44) METAP2FFAR4MMP1MMP13MEN1
SCHEMBL7325546 0.81 METAP2 (0.56) METAP2MMP13MEN1KMT2AMMP9
SCHEMBL7313794 0.80 MTNR1A (0.42) MMP1MMP13MEN1KMT2AGAA

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-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed