SCHEMBL352205

SCHEMBL352205

CCN(C(=O)COC)c1nsc2cccc(OC(F)F)c12

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 5/20 0.34
HCRTR2 O43614 5/20 0.34
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TSHR P16473 1/20 0.32
RAB9A P51151 1/20 0.32
HPGD P15428 1/20 0.32
CASP1 P29466 1/20 0.32
KCNA5 P22460 1/20 0.31
CRHR1 P34998 1/20 0.31
MAPT P10636 2/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NR1I2 O75469 1/20 0.31
PDE4B Q07343 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
SCHEMBL10167494 0.90 HCRTR1 (0.36) HCRTR1HCRTR2MEN1KMT2ATSHR
SCHEMBL10167672 0.88 HCRTR1 (0.35) HCRTR1HCRTR2MEN1KMT2ATSHR
SCHEMBL355401 0.87 HPGD (0.34) HCRTR1HCRTR2MEN1KMT2ATSHR
SCHEMBL10167489 0.87 HCRTR1 (0.38) HCRTR1HCRTR2MEN1KMT2ATSHR
SCHEMBL291192 0.84 HCRTR1 (0.37) HCRTR1HCRTR2MEN1KMT2ATSHR
SCHEMBL10167495 0.83 MEN1 (0.41) HCRTR1HCRTR2MEN1KMT2ATSHR
SCHEMBL354766 0.83 HCRTR1 (0.35) HCRTR1HCRTR2
SCHEMBL10167492 0.82 MAPT (0.36) HCRTR1HCRTR2MAPTKDM4ELMNA
SCHEMBL10167484 0.80 HCRTR1 (0.35) HCRTR1HCRTR2MEN1KMT2ATSHR
SCHEMBL13903694 0.79 KDM4E (0.34) HCRTR1HCRTR2KCNA5CRHR1MAPT

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
EP-2064196-B1 3-AMINO-1,2-BENZISOTHIAZOLE COMPOUNDS FOR COMBATING ANIMAL PEST II BASF SE (DE) 2012-03-14 EP disclosed
US-8119568-B2 3-amino-1,2-benzisothiazole compounds for combating animal pest II BASF SE (DE) 2012-02-21 US disclosed
US-8119568-B2 3-amino-1,2-benzisothiazole compounds for combating animal pest II BASF SE (DE) 2012-02-21 US disclosed
US-20100009848-A1 3-Amino-1,2-Benzisothiazole Compounds for Combating Animal Pest II BASF SE (DE) 2010-01-14 US disclosed
US-20100009848-A1 3-Amino-1,2-Benzisothiazole Compounds for Combating Animal Pest II BASF SE (DE) 2010-01-14 US disclosed
WO-2008090048-A2 3-AMINO-1,2-BENZISOTHIAZOLE COMPOUNDS FOR COMBATING ANIMAL PEST II BASF SE (DE) 2008-07-31 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 (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-20100009848-A1 3-Amino-1,2-Benzisothiazole Compounds for Combating Animal Pest II BPNT1, BCAT1, TGFBR1 HCRTR1 1004/4885HCRTR2 2047/4885MEN1 3020/4885

“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.