SCHEMBL3760673

SCHEMBL3760673

Cc1ccc(S(=O)(=O)OCc2cc(C(C)O[Si](C)(C)C(C)(C)C)on2)cc1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA9 Q16790 1/20 0.32
GAA P10253 1/20 0.31
APLNR P35414 3/20 0.31
BCHE P06276 2/20 0.31
ACHE P22303 2/20 0.31
STAT3 P40763 1/20 0.31
BMP1 P13497 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
SCHEMBL3772018 0.83 SMN1; SMN2 (0.42) MEN1KMT2AALDH1A1CA12CA1
SCHEMBL26970922 0.79 LMNA (0.44) MEN1KMT2AALDH1A1CA12CA1
SCHEMBL27246864 0.76 EDNRB (0.39) MEN1KMT2AALDH1A1CA12CA1
SCHEMBL5788622 0.76 CA12 (0.36) MEN1KMT2ACA12CA1CA9
SCHEMBL21329586 0.75 MEN1 (0.39) MEN1KMT2AALDH1A1CA12CA1
SCHEMBL21330105 0.75 MEN1 (0.39) MEN1KMT2AALDH1A1CA12CA1
SCHEMBL21329582 0.75 MEN1 (0.39) MEN1KMT2AALDH1A1CA12CA1
SCHEMBL18029887 0.75 ALDH1A1 (0.36) MEN1KMT2AALDH1A1CA12CA1
SCHEMBL157669 0.75 STAT3 (0.33) MEN1KMT2AALDH1A1CA12CA1
SCHEMBL15237657 0.75 ALDH1A1 (0.36) MEN1KMT2AALDH1A1CA12CA1

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-7846956-B2 Malononitrile compound as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-07 US disclosed
US-7846956-B2 Malononitrile compound as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-07 US disclosed
US-20090149425-A1 Malononitrile compound as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-11 US disclosed
US-20090149425-A1 Malononitrile compound as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-11 US disclosed
EP-1704143-B1 MALONONITRILE COMPOUND AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2008-09-03 EP 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-20090149425-A1 Malononitrile compound as pesticides NR0B1, RTN4, OR10J3 MEN1 929/4885KMT2A 3120/4885ALDH1A1 2751/4885

“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.