SCHEMBL12436006

SCHEMBL12436006

COc1cc(NS(=O)(=O)c2ccc(CO)c(N)c2)cc(OC)c1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
LMNA P02545 6/20 0.49
MAPT P10636 4/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
MMP1 P03956 1/20 0.48
MMP2 P08253 1/20 0.48
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48
MMP13 P45452 1/20 0.48
THRB P10828 2/20 0.47
TP53 P04637 2/20 0.47
PKM P14618 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPK1 P28482 2/20 0.46
F2 P00734 2/20 0.44
PRSS1 P07477 2/20 0.44
PRSS2 P07478 2/20 0.44

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
SCHEMBL12436012 0.86 LMNA (0.50) HTTSMN1; SMN2LMNAMAPTTHRB
SCHEMBL2215125 0.84 CA1 (0.62) HTTSMN1; SMN2LMNAMAPTCA1
Hydrochloric Acid SCHEMBL6339594 0.83 CA1 (0.61) HTTSMN1; SMN2LMNAMAPTCA1
SCHEMBL12435989 0.80 SMN1; SMN2 (0.58) HTTSMN1; SMN2LMNAMAPTTHRB
SCHEMBL6350411 0.79 HTR6 (0.65) HTTSMN1; SMN2LMNAMAPTCA1
SCHEMBL6341219 0.77 LMNA (0.79) HTTSMN1; SMN2LMNAMAPTPKM
SCHEMBL6048148 0.74 CYP19A1 (0.65) HTTSMN1; SMN2LMNAPKMMAPK1
SCHEMBL28864522 0.74 LMNA (0.68) HTTSMN1; SMN2LMNAMAPTCA1
SCHEMBL12435902 0.74 ATM (0.56) HTTSMN1; SMN2LMNAMAPTTP53
SCHEMBL5280989 0.73 LMNA (0.55) HTTSMN1; SMN2LMNAMAPTTHRB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110178108-A1 Group of amino substituted benzoyl derivatives and their preparation and their use Institute of Medicinal Biotechnology Academy of Medical Science (CN) 2011-07-21 US disclosed
US-20110178108-A1 Group of amino substituted benzoyl derivatives and their preparation and their use Institute of Medicinal Biotechnology Academy of Medical Science (CN) 2011-07-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110178108-A1 Group of amino substituted benzoyl derivatives and their preparation and their use CUL3, APOBEC3G, BRPF3 HTT 1248/4885SMN1; SMN2 4598/4885LMNA 2812/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.