SCHEMBL9706817

SCHEMBL9706817

Cc1ccc(S(=O)(=O)NC(C)C(=O)Oc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.65
MAPT P10636 3/20 0.65
RAB9A P51151 2/20 0.65
NPC1 O15118 1/20 0.65
KMT2A Q03164 2/20 0.56
MMP2 P08253 3/20 0.50
ALDH1A1 P00352 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MMP1 P03956 2/20 0.50
MMP9 P14780 2/20 0.50
MMP13 P45452 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
MMP3 P08254 1/20 0.50
MMP7 P09237 1/20 0.50
POLB P06746 1/20 0.50
CA2 P00918 3/20 0.47
CA12 O43570 2/20 0.47
CA9 Q16790 2/20 0.47
CA14 Q9ULX7 2/20 0.47
TSHR P16473 1/20 0.46

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
SCHEMBL7776370 1.00 HTT (0.65) HTTMAPTRAB9ANPC1KMT2A
SCHEMBL19404003 0.90 HTT (0.54) HTTMAPTRAB9ANPC1MMP2
SCHEMBL24211175 0.85 HSD17B10 (0.50) HTTMAPTRAB9ANPC1KMT2A
SCHEMBL9764157 0.84 HTT (0.49) HTTMAPTRAB9ANPC1KMT2A
SCHEMBL10780607 0.83 ADAMTS4 (0.54) HTTMAPTRAB9ANPC1KMT2A
SCHEMBL21814531 0.81 HTT (0.49) HTTMAPTRAB9ANPC1MMP2
SCHEMBL21814588 0.81 HTT (0.49) HTTMAPTRAB9ANPC1MMP2
P-Nitrophenol SCHEMBL7776372 0.79 MMP9 (0.57) HTTMAPTRAB9ANPC1KMT2A
SCHEMBL22492652 0.77 MMP2 (0.68) HTTKMT2AMMP2ALDH1A1SMN1; SMN2
SCHEMBL5193258 0.77 MMP2 (0.68) HTTKMT2AMMP2ALDH1A1SMN1; SMN2

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-0464388-A1 Detection assays having chromogenic and nonchromogenic, hypocromogenic, bathochromogenic or hypsochromogenic substrates TECHNICON INSTRUMENTS CORPORATION (a New York corporation) (US) 1992-01-08 EP disclosed