SCHEMBL12604643

SCHEMBL12604643

NC1NS(=O)(=O)Oc2cccc(F)c21

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMARCA2 P51531 2/20 0.31
SMARCA4 P51532 2/20 0.31
PBRM1 Q86U86 2/20 0.31
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30
CA12 O43570 1/20 0.30

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
SCHEMBL1266571 0.61 CYP19A1 (0.38) HTR2CHTR2B
SCHEMBL1783661 0.60 BACE1 (0.34)
Hydrochloric Acid SCHEMBL30818117 0.60 HTR2C (0.40) HTR2CHTR2B
SCHEMBL26962672 0.59 MAP3K14 (0.45) HTR2CHTR2B
SCHEMBL1266237 0.59 MAP3K14 (0.45) HTR2CHTR2B
SCHEMBL30216657 0.59 MAP3K14 (0.45) HTR2CHTR2B
SCHEMBL30913028 0.58 MAOB (0.42)
SCHEMBL14818084 0.58 PBRM1 (0.41) SMARCA2SMARCA4PBRM1HTR2CHTR2B
SCHEMBL30913032 0.57 KMT2A (0.37)
SCHEMBL20110650 0.57 CA1 (0.38) SMARCA2SMARCA4PBRM1HTR2CHTR2B

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-20110118240-A2 4-Amino-1,2,3-Benzoxathiazine-Derivatives as Pesticides BAYER CROPSCIENCE AG (DE) 2011-05-19 US disclosed
US-20110118240-A2 4-Amino-1,2,3-Benzoxathiazine-Derivatives as Pesticides BAYER CROPSCIENCE AG (DE) 2011-05-19 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-20110118240-A2 4-Amino-1,2,3-Benzoxathiazine-Derivatives as Pesticides P2RX5, P2RX4, SLC1A5 SMARCA2 4206/4885SMARCA4 3697/4885PBRM1 651/4885

“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.