SCHEMBL10085517

SCHEMBL10085517

N#Cc1cc(F)ccc1OS

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.45
TRPV4 Q9HBA0 2/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
SLC22A12 Q96S37 4/20 0.41
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.39
USP2 O75604 1/20 0.39
FFAR1 O14842 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
EPAS1 Q99814 3/20 0.36
MEN1 O00255 2/20 0.36
HPGD P15428 2/20 0.36
KMT2A Q03164 2/20 0.36
IMPDH2 P12268 1/20 0.35
IMPDH1 P20839 1/20 0.35
VEGFA P15692 1/20 0.35
XDH P47989 1/20 0.35

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
SCHEMBL573864 0.83 MAOB (0.53) ARTRPV4MAOAMAOBSLC22A12
SCHEMBL2131318 0.80 ALDH1A1 (0.61) ARSLC22A12KDM4EALDH1A1USP2
Ethylene SCHEMBL27960950 0.79 MAOB (0.50) ARTRPV4MAOAMAOBSLC22A12
SCHEMBL23753793 0.77 AR (0.50) ARMAOAMAOBSLC22A12KDM4E
SCHEMBL29846977 0.77 AR (0.50) ARMAOAMAOBSLC22A12KDM4E
SCHEMBL13485290 0.76 AR (0.49) ARMAOAMAOBSLC22A12ALDH1A1
SCHEMBL13285468 0.76 AR (0.42) ARTRPV4MAOAMAOBSLC22A12
SCHEMBL12233210 0.76 AR (0.42) ARTRPV4MAOAMAOBSLC22A12
SCHEMBL4422120 0.76 AR (0.46) ARMAOAMAOBSLC22A12KDM4E
SCHEMBL30522390 0.76 AR (0.42) ARTRPV4MAOAMAOBSLC22A12

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-8173641-B2 4-amino-1,2,3-benzoxathiazine-derivatives as pesticides BAYER CROPSCIENCE AG (DE) 2012-05-08 US disclosed
US-20100267703-A1 4-Amino-1,2,3-benzoxathiazine-Derivatives as Pesticides BAYER CROPSCIENCE AG (DE) 2010-10-21 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-20100267703-A1 4-Amino-1,2,3-benzoxathiazine-Derivatives as Pesticides P2RX5, SLC1A5, P2RX4 AR 1469/4885TRPV4 633/4885MAOA 4380/4885

“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.