SCHEMBL10167682

SCHEMBL10167682

O=C(Nc1nsc2cccc(Br)c12)c1cc(C(F)(F)F)nn1-c1ncccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 3/20 0.36
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
CARM1 Q86X55 3/20 0.35
DHODH Q02127 1/20 0.35
TRPV1 Q8NER1 2/20 0.34
F10 P00742 5/20 0.34
F9 P00740 4/20 0.34
MALT1 Q9UDY8 1/20 0.34
F2 P00734 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
USP2 O75604 1/20 0.33

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
SCHEMBL10167587 0.93 KLKB1 (0.38) KLKB1KDM4EMEN1ALDH1A1MAPT
SCHEMBL10167663 0.90 KLKB1 (0.36) KLKB1KDM4EMEN1ALDH1A1MAPT
SCHEMBL10167687 0.89 DHODH (0.39) ALDH1A1DHODHTRPV1MALT1USP2
SCHEMBL10167606 0.88 DHODH (0.39) MAPTCARM1DHODHF10MALT1
SCHEMBL10167675 0.86 KDM4E (0.35) KLKB1KDM4EMEN1ALDH1A1MAPT
SCHEMBL10167593 0.86 MAPT (0.37) KLKB1KDM4EMEN1ALDH1A1MAPT
SCHEMBL10167586 0.83 DHODH (0.40) ALDH1A1DHODHTRPV1MALT1USP2
SCHEMBL10167665 0.83 TRPV1 (0.41) KLKB1KDM4EMEN1ALDH1A1MAPT
SCHEMBL10167681 0.83 TRPV1 (0.41) KLKB1KDM4EMEN1ALDH1A1MAPT
SCHEMBL10167677 0.82 CARM1 (0.39) KLKB1KDM4EMEN1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 KLKB1 4302/4885KDM4E 3057/4885MEN1 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.