SCHEMBL6557101

SCHEMBL6557101

COc1cc(CCNC(=O)[C@@H](NS(C)(=O)=O)C(C)C)ccc1OCCSc1ccc(Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
LMNA P02545 6/20 0.48
GAA P10253 1/20 0.47
ALDH1A1 P00352 4/20 0.46
MAPT P10636 3/20 0.46
HPGD P15428 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
CNR1 P21554 1/20 0.46
CTSD P07339 1/20 0.44
POLB P06746 1/20 0.43

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
SCHEMBL13350377 0.90 KMT2A (0.52) KMT2AMEN1LMNAGAAALDH1A1
SCHEMBL6553795 0.90 KMT2A (0.51) KMT2AMEN1LMNAGAAALDH1A1
SCHEMBL6554738 0.89 KMT2A (0.51) KMT2AMEN1LMNAGAAALDH1A1
SCHEMBL7157119 0.84 GAA (0.52) KMT2AMEN1LMNAGAAALDH1A1
SCHEMBL13350353 0.82 KMT2A (0.51) KMT2AMEN1LMNAGAAALDH1A1
SCHEMBL157178 0.82 KMT2A (0.48) KMT2AMEN1LMNAGAAALDH1A1
SCHEMBL29419083 0.82 KMT2A (0.48) KMT2AMEN1LMNAGAAALDH1A1
SCHEMBL483297 0.82 KMT2A (0.48) KMT2AMEN1LMNAGAAALDH1A1
SCHEMBL82268 0.82 KMT2A (0.48) KMT2AMEN1LMNAGAAALDH1A1
SCHEMBL6554848 0.82 LMNA (0.46) KMT2AMEN1LMNAALDH1A1MAPT

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
EP-1135368-B1 ALPHA-SULFIN- AND ALPHA-SULFON-AMINO ACID AMIDES SYNGENTA PARTICIPATIONS AG (CH) 2004-02-25 EP disclosed
US-6538016-B2 For controlling and preventing an infestation of crop plants by phytopathogenic microorganisms, preferably fungi SYNGENTA PARTICIPATIONS AG (CH) 2003-03-25 US disclosed
US-20020082452-A1 alpha-sulfin-and alpha-sulfonamino acid amides SYNGENTA PARTICIPATIONS AG (CH) 2002-06-27 US disclosed
EP-1135368-A2 ALPHA-SULFIN- AND ALPHA-SULFON-AMINO ACID AMIDES Syngenta Participations AG (CH) 2001-09-26 EP disclosed
WO-2000032568-A2 $G(A)-SULFIN- AND $G(A)-SULFONAMINO ACID AMIDES SYNGENTA PARTICIPATIONS AG (CH) 2000-06-08 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-20020082452-A1 alpha-sulfin-and alpha-sulfonamino acid amides SULT1A1, CBR1, SULT2A1 KMT2A 2647/4885MEN1 3649/4885LMNA 2593/4885

“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.