SCHEMBL7314232

SCHEMBL7314232

COC(=O)c1c(Cc2ccccc2Br)c(C)c(N)c(C)c1S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 12/20 0.48
MMP12 P39900 12/20 0.48
MMP9 P14780 12/20 0.48
MMP13 P45452 10/20 0.48
MMP8 P22894 9/20 0.48
MMP14 P50281 9/20 0.48
MMP16 P51512 9/20 0.48
MMP3 P08254 6/20 0.48
MMP1 P03956 6/20 0.48
ADAM17 P78536 1/20 0.48
PTGDR2 Q9Y5Y4 2/20 0.41
TP53 P04637 2/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
LMNA P02545 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
SCHEMBL7324634 0.91 MMP9 (0.50) MMP2MMP12MMP9MMP13MMP8
SCHEMBL7315652 0.91 MMP2 (0.49) MMP2MMP12MMP9MMP13MMP8
SCHEMBL7317410 0.87 ALDH1A1 (0.47) MMP2MMP12MMP9MMP13MMP8
SCHEMBL7315402 0.85 EGFR (0.45) MMP2MMP12MMP9MMP13MMP8
SCHEMBL7311138 0.84 MMP13 (0.39) MMP2MMP12MMP9MMP13MMP8
SCHEMBL7317696 0.83 LMNA (0.42) MMP2MMP12MMP9MMP13MMP8
SCHEMBL7324368 0.82 CA1 (0.42) MMP2MMP12MMP9MMP13MMP8
SCHEMBL7313804 0.82 ALDH1A1 (0.45) MMP2MMP12MMP9MMP13MMP8
SCHEMBL7323459 0.82 LMNA (0.41) MMP2MMP12MMP9MMP13MMP8
SCHEMBL7324058 0.80 NAMPT (0.49) MMP9MMP13MMP1ADAM17ALDH1A1

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