SCHEMBL7029301

SCHEMBL7029301

CN(C)C=NS(=O)(=O)c1cccc(N)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
GAA P10253 1/20 0.54
F2 P00734 3/20 0.53
PRSS1 P07477 3/20 0.53
PRSS2 P07478 3/20 0.53
PRSS3 P35030 3/20 0.53
CA2 P00918 3/20 0.49
CA12 O43570 2/20 0.49
CA1 P00915 2/20 0.49
CA4 P22748 2/20 0.49
CA9 Q16790 2/20 0.49
CA14 Q9ULX7 1/20 0.49
ALDH1A1 P00352 3/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
POLB P06746 2/20 0.41
BCAT1 P54687 1/20 0.41
CYP19A1 P11511 1/20 0.39
PKM P14618 1/20 0.38

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
SCHEMBL7029298 1.00 LMNA (0.54) LMNAGAAF2PRSS1PRSS2
SCHEMBL3528429 0.81 LMNA (0.54) LMNAGAAALDH1A1BCAT1
SCHEMBL3528433 0.81 LMNA (0.54) LMNAGAAALDH1A1BCAT1
SCHEMBL7673667 0.80 LMNA (0.71) LMNAGAAF2PRSS1PRSS2
SCHEMBL7673670 0.80 LMNA (0.71) LMNAGAAF2PRSS1PRSS2
SCHEMBL4972178 0.79 LMNA (0.70) LMNAGAAALDH1A1BCAT1
SCHEMBL4110091 0.79 LMNA (0.70) LMNAGAAALDH1A1BCAT1
SCHEMBL2439782 0.77 LMNA (0.58) LMNAGAAF2PRSS1PRSS2
SCHEMBL2439780 0.77 LMNA (0.58) LMNAGAAF2PRSS1PRSS2
SCHEMBL7613335 0.76 LMNA (0.65) LMNAGAACA2CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1322602-A1 SUBSTITUTED CINNAMIC ACID GUANIDIDES, METHOD FOR THE PRODUCTION THEREOF, THEIR USE AS A MEDICAMENT, AND TO A MEDICAMENT CONTAINING THESE COMPOUNDS Aventis Pharma Deutschland GmbH (DE) 2003-07-02 EP disclosed
US-6399824-B1 FOR THERAPY AND PROPHYLAXIS OF ARRHYTHMIAS, CARDIAC INFRACTION, ISCHEMIC CONDITIONS, ANGINA PECTORIS, SHOCK, FOR PRESERVING AND STORING A TRANSPLANT FOR SURGICAL MEASURE AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-06-04 US disclosed
US-20020058710-A1 SUBSTITUTED CINNAMIC, ACID GUANIDIDES, PROCESS FOR THEIR PREPARATION, THEIR USE AS A MEDICAMENT, AND MEDICAMENT COMPRISING THEM AVENTIS PHARMA DEUTSCHLAND GMBH. 2002-05-16 US disclosed
WO-2002024637-A1 SUBSTITUTED CINNAMIC ACID GUANIDIDES, METHOD FOR THE PRODUCTION THEREOF, THEIR USE AS A MEDICAMENT, AND TO A MEDICAMENT CONTAINING THESE COMPOUNDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-03-28 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-20020058710-A1 SUBSTITUTED CINNAMIC, ACID GUANIDIDES, PROCESS FOR THEIR PREPARATION, THEIR USE AS A MEDICAMENT, AND MEDICAMENT COMPRISING THEM GANC, GMPS, GCDH LMNA 431/4885GAA 11/4885F2 3437/4885

“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.