SCHEMBL6554796

SCHEMBL6554796

CCS(=O)(=O)N[C@H](C(=O)NCCc1ccc(OC/C=C\Oc2ccccc2)c(OC)c1)C(C)C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 2/20 0.46
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 3/20 0.42
MAPT P10636 2/20 0.42
HTT P42858 2/20 0.42
RAB9A P51151 1/20 0.41
TSHR P16473 1/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40

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
SCHEMBL6554806 1.00 SMN1; SMN2 (0.46) SMN1; SMN2LMNAALDH1A1KMT2AMAPT
SCHEMBL6554811 1.00 SMN1; SMN2 (0.46) SMN1; SMN2LMNAALDH1A1KMT2AMAPT
SCHEMBL6556797 0.88 MAPT (0.52) SMN1; SMN2LMNAALDH1A1KMT2AMAPT
SCHEMBL6556802 0.88 MAPT (0.52) SMN1; SMN2LMNAALDH1A1KMT2AMAPT
SCHEMBL6556803 0.88 MAPT (0.52) SMN1; SMN2LMNAALDH1A1KMT2AMAPT
SCHEMBL7896834 0.86 SMN1; SMN2 (0.48) SMN1; SMN2LMNAALDH1A1KMT2AMAPT
SCHEMBL7896831 0.86 SMN1; SMN2 (0.48) SMN1; SMN2LMNAALDH1A1KMT2AMAPT
SCHEMBL7605247 0.84 MTNR1A (0.56) SMN1; SMN2LMNAALDH1A1KMT2ARAB9A
SCHEMBL6556876 0.82 KMT2A (0.47) SMN1; SMN2LMNAALDH1A1KMT2AMAPT
SCHEMBL6556885 0.82 KMT2A (0.47) SMN1; SMN2LMNAALDH1A1KMT2AMAPT

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 SMN1; SMN2 1554/4885LMNA 2593/4885ALDH1A1 112/4885

“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.