SCHEMBL7314515

SCHEMBL7314515

COC(=O)c1cc(OC)c(OC)c(OC)c1NCc1cccnc1S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
POLB P06746 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MMP2 P08253 6/20 0.39
MMP12 P39900 6/20 0.39
MMP9 P14780 5/20 0.39
MMP8 P22894 5/20 0.39
MMP13 P45452 5/20 0.39
MMP14 P50281 5/20 0.39
MMP16 P51512 5/20 0.39
MMP1 P03956 4/20 0.39
MMP3 P08254 4/20 0.39
ADAM17 P78536 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 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
SCHEMBL7322214 0.93 KDM4E (0.40) KDM4EMMP2MMP12MMP9MMP8
SCHEMBL7318027 0.91 MMP13 (0.44) MMP2MMP12MMP9MMP8MMP13
SCHEMBL7324047 0.84 GABRG2 (0.42) MMP2MMP12MMP9MMP8MMP13
SCHEMBL7316602 0.84 MMP13 (0.43) MMP2MMP12MMP9MMP8MMP13
SCHEMBL7319136 0.84 SMN1; SMN2 (0.40) KDM4EPOLBMMP2MMP12MMP9
SCHEMBL7317430 0.83 MMP9 (0.44) KDM4EMMP2MMP12MMP9MMP8
SCHEMBL7316579 0.82 KDM4E (0.44) KDM4EMMP2MMP12MMP9MMP8
SCHEMBL7317521 0.82 MMP13 (0.41) KDM4EMMP2MMP12MMP9MMP8
SCHEMBL7322262 0.82 LMNA (0.43) KDM4EMMP2MMP12MMP9MMP8
SCHEMBL7322032 0.81 MMP13 (0.40) KDM4EUSP2HSD17B10MMP2MMP12

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