SCHEMBL4770596

SCHEMBL4770596

CC(C)(C)OC(=O)N1CCN(Cc2ccc(NS(=O)(=O)CCc3cccc(Cl)c3Cl)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPRB P23467 1/20 0.44
PTPN11 Q06124 1/20 0.44
VEGFA P15692 1/20 0.44
EGLN1 Q9GZT9 1/20 0.44
STS P08842 4/20 0.43
ALDH1A1 P00352 1/20 0.41
ACKR3 P25106 1/20 0.41
TGM2 P21980 3/20 0.40
F13A1 P00488 2/20 0.40
TGM1 P22735 2/20 0.40
TGM3 Q08188 1/20 0.40
MAPK8 P45983 1/20 0.40
TGFBR1 P36897 2/20 0.40
SETD7 Q8WTS6 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ENPP2 Q13822 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL20394977 0.86 FAAH (0.43) ALDH1A1MEN1KMT2ALMNA
SCHEMBL5571647 0.86 MAPK14 (0.47) ACKR3LMNA
SCHEMBL4768017 0.85 STS (0.52) PTPRBPTPN11STSTGFBR1MAPT
SCHEMBL18425032 0.81 VEGFA (0.48) PTPRBPTPN11VEGFAEGLN1STS
SCHEMBL5567927 0.81 STS (0.45) PTPRBPTPN11STSTGFBR1LMNA
SCHEMBL4773426 0.79 NAMPT (0.43) MEN1KMT2ALMNAMAPT
SCHEMBL4776450 0.79 STAT3 (0.44) LMNAMAPT
SCHEMBL5568808 0.79 STS (0.54) STSALDH1A1LMNAMAPT
SCHEMBL20394953 0.78 ACKR3 (0.38) ALDH1A1ACKR3MEN1KMT2A
SCHEMBL4770599 0.78 VEGFA (0.44) PTPRBPTPN11VEGFAEGLN1STS

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-2344456-B1 NOVEL POTASSIUM CHANNEL BLOCKER JAPAN TOBACCO INC (JP) 2018-07-25 EP claimed
US-20070135435-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-14 US claimed
EP-1942888-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2008-07-16 EP disclosed
US-20070135435-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-14 US disclosed
WO-2007056078-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2007-05-18 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-20070135435-A1 Certain chemical entities, compositions, and methods KIF5B, KIF2C, PLK1 PTPRB 1981/4885PTPN11 3851/4885VEGFA 4637/4885

“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.