SCHEMBL2373539

SCHEMBL2373539

O=S1(=O)C(c2ccccc2C(F)(F)F)=C(O)c2ncccc2N1CC(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.37
HSD11B1 P28845 2/20 0.36
SLC6A7 Q99884 1/20 0.36
TRPV1 Q8NER1 3/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA9 Q16790 1/20 0.34
KCNN4 O15554 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
TGFBR1 P36897 1/20 0.33
KMO O15229 1/20 0.33
AKT1 P31749 1/20 0.33
PRKCB P05771 1/20 0.32
GSK3B P49841 1/20 0.32
SCN5A Q14524 1/20 0.32
SCN9A Q15858 1/20 0.32
ELANE P08246 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL442606 0.85 HSD11B1 (0.40) RBP4HSD11B1SLC6A7CA12CA1
SCHEMBL409942 0.85 SLC6A7 (0.33) SLC6A7KCNN4TP53MAPTAKT1
SCHEMBL2373555 0.79 KCNN4 (0.34) KCNN4SCN9AHTR2A
SCHEMBL442604 0.78 P2RX7 (0.31) ELANEKDM4ECYP1A2CYP2C19TDP1
SCHEMBL2373398 0.74 BRAF (0.36) MAPTALDH1A1TSHR
SCHEMBL12296240 0.74
SCHEMBL410925 0.74 TACR1 (0.34) TRPV1TP53MAPTKDM4ECYP1A2
SCHEMBL14920004 0.73
SCHEMBL442116 0.73 MAPT (0.39) RBP4HSD11B1SLC6A7TRPV1KCNN4
SCHEMBL12296769 0.72 KCNN4 (0.34) KCNN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140256950-A1 PROCESSES FOR THE PREPARATION OF 4-AMINO-2-(2,6-DIOXOPIPERIDIN-3-YL)ISOINDOLINE-1,3-DIONE COMPOUNDS CELGENE CORPORATION (US) 2014-09-11 US disclosed
EP-2550280-B1 PYRIDOTHIAZINES HAVING HERBICIDAL ACTION BASF SE (DE) 2014-02-26 EP disclosed
US-8440594-B2 Pyridothiazines having herbicidal action BASF SE (DE) 2013-05-14 US disclosed
EP-2550280-A1 PYRIDOTHIAZINES HAVING HERBICIDAL ACTION BASF SE (DE) 2013-01-30 EP disclosed
US-20130005575-A1 Pyridothiazines Having Herbicidal Action BASF SE (DE) 2013-01-03 US disclosed
WO-2011117152-A1 PYRIDOTHIAZINES HAVING HERBICIDAL ACTION BASF SE (DE) 2011-09-29 WO 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 (2 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-20130005575-A1 Pyridothiazines Having Herbicidal Action PNPO, PDXK, PLPBP RBP4 3042/4885HSD11B1 1390/4885SLC6A7 841/4885
US-20140256950-A1 PROCESSES FOR THE PREPARATION OF 4-AMINO-2-(2,6-DIOXOPIPERIDIN-3-YL)ISOINDOLINE-1,3-DIONE COMPOUNDS TNF, TRAF2, IL1A RBP4 3761/4885HSD11B1 1504/4885SLC6A7 4078/4885

“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.