SCHEMBL2180145

SCHEMBL2180145

CSc1[c]ncc(SC(F)(F)F)c1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL2177671 0.87 KDM4E (0.33) SMN1; SMN2KDM4EALDH1A1TDP1
SCHEMBL2177714 0.81
SCHEMBL2179458 0.78 SMN1; SMN2 (0.36) SMN1; SMN2KDM4EALDH1A1TDP1
SCHEMBL2177580 0.76 RAB9A (0.32) SMN1; SMN2KDM4E
SCHEMBL2180835 0.76 KDM4E (0.33) SMN1; SMN2KDM4EALDH1A1TDP1
SCHEMBL2179931 0.74 KDM4E (0.32) KDM4EALDH1A1TDP1
SCHEMBL2178456 0.74 KDM4E (0.32) KDM4EALDH1A1TDP1
SCHEMBL2179831 0.74 HTR2A (0.31) SMN1; SMN2
SCHEMBL2178772 0.74 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL2177934 0.74 SMN1; SMN2 (0.30) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110166162-A1 1,2-Benzisothiazole Compounds Useful for Combating Animal Pests BASF SE (DE) 2011-07-07 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-20110166162-A1 1,2-Benzisothiazole Compounds Useful for Combating Animal Pests GLRX3, CBR3, PRDX1 SMN1; SMN2 2625/4885KDM4E 4261/4885ALDH1A1 2095/4885

“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.