SCHEMBL8628546

SCHEMBL8628546

COc1ccc(S(=O)(=O)O)c(Cc2ccccc2[N+](=O)[O-])c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.47
MMP2 P08253 2/20 0.47
MMP9 P14780 2/20 0.47
MMP8 P22894 2/20 0.47
MMP13 P45452 2/20 0.47
CA2 P00918 1/20 0.47
PTPN1 P18031 1/20 0.45
MAPT P10636 3/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 4/20 0.44
LMNA P02545 3/20 0.44
KDM4E B2RXH2 2/20 0.43
POLB P06746 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MAOB P27338 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CYP19A1 P11511 1/20 0.41

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
SCHEMBL8628551 1.00 MMP1 (0.47) MMP1MMP2MMP9MMP8MMP13
SCHEMBL196533 0.84 ACHE (0.46) MAPTKMT2AMEN1ALDH1A1NPC1
SCHEMBL1228376 0.84 ACHE (0.46) MAPTKMT2AMEN1ALDH1A1NPC1
SCHEMBL14991138 0.83 HSD17B10 (0.44) MMP2MMP8MMP13CA2MAPT
SCHEMBL7902462 0.80 KMT2A (0.38) MMP1MMP2MMP9MMP8MMP13
SCHEMBL7902467 0.80 KMT2A (0.38) MMP1MMP2MMP9MMP8MMP13
SCHEMBL3906545 0.79 POLB (0.52) MAPTKMT2AMEN1ALDH1A1LMNA
Water SCHEMBL3157352 0.77 POLB (0.51) MAPTKMT2AMEN1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL27447923 0.77 POLB (0.51) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL10350813 0.76 ALDH1A1 (0.47) MAPTKMT2AMEN1ALDH1A1LMNA

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
EP-0848288-A1 Resist materials LUCENT TECHNOLOGIES INC. (US) 1998-06-17 EP disclosed