SCHEMBL964882

SCHEMBL964882

CS(=O)(=O)N(Cc1ccccc1)c1cc(C(O)CBr)ccc1OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
ALDH1A1 P00352 4/20 0.43
PTPN1 P18031 3/20 0.42
PTPN2 P17706 2/20 0.42
PTPN6 P29350 2/20 0.42
CYP19A1 P11511 4/20 0.42
PTPRF P10586 1/20 0.40
PTPN11 Q06124 1/20 0.40
ACLY P53396 1/20 0.40
ACP1 P24666 1/20 0.38
PTPN12 Q05209 1/20 0.38
PTPN13 Q12923 1/20 0.38
SSU72 Q9NP77 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 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
SCHEMBL964883 1.00 L3MBTL1 (0.44) L3MBTL1ALDH1A1PTPN1PTPN2PTPN6
SCHEMBL7532766 0.89 L3MBTL1 (0.44) L3MBTL1ALDH1A1PTPN1PTPN2PTPN6
SCHEMBL7536141 0.89 L3MBTL1 (0.44) L3MBTL1ALDH1A1PTPN1PTPN2PTPN6
SCHEMBL14090694 0.89 CYP19A1 (0.45) CYP19A1ACP1PTPN12PTPN13SSU72
SCHEMBL7618225 0.88 L3MBTL1 (0.40) L3MBTL1ALDH1A1PTPN1PTPN2PTPN6
SCHEMBL7527737 0.86 POLB (0.43) L3MBTL1ALDH1A1PTPN1PTPN2PTPN6
SCHEMBL7621987 0.86 POLB (0.43) L3MBTL1ALDH1A1PTPN1PTPN2PTPN6
SCHEMBL4629374 0.85 ADRB3 (0.47) L3MBTL1ALDH1A1
SCHEMBL27575302 0.84 ADRB3 (0.43) L3MBTL1ALDH1A1PTPN1PTPN2PTPN6
SCHEMBL7606232 0.83 CYP19A1 (0.41) CYP19A1ACP1PTPN12PTPN13SSU72

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-2035004-B1 PHENYL SUBSTITUTED PYRAZINOYLGUANIDINE SODIUM CHANNEL BLOCKERS POSSESSING BETA AGONIST ACTIVITY PARION SCIENCES INC (US) 2012-08-08 EP disclosed
US-8163758-B2 Phenyl substituted pyrazinoylguanidine sodium channel blockers possessing beta agonist activity PARION SCIENCES, INC. (US) 2012-04-24 US disclosed
US-20110008268-A1 PHENYL SUBSTITUTED PYRAZINOYLGUANIDINE SODIUM CHANNEL BLOCKERS POSSESSING BETA AGONIST ACTIVITY PARION SCIENCES, INC. (US) 2011-01-13 US disclosed
EP-2035004-A1 PHENYL SUBSTITUTED PYRAZINOYLGUANIDINE SODIUM CHANNEL BLOCKERS POSSESSING BETA AGONIST ACTIVITY Parion Sciences, Inc. (US) 2009-03-18 EP disclosed
WO-2007146869-A1 PHENYL SUBSTITUTED PYRAZINOYLGUANIDINE SODIUM CHANNEL BLOCKERS POSSESSING BETA AGONIST ACTIVITY PARION SCIENCES, INC. (US) 2007-12-21 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-20110008268-A1 PHENYL SUBSTITUTED PYRAZINOYLGUANIDINE SODIUM CHANNEL BLOCKERS POSSESSING BETA AGONIST ACTIVITY CACNA1C, CACNA1B, CACNA1G L3MBTL1 3988/4885ALDH1A1 1434/4885PTPN1 1867/4885

“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.