SCHEMBL3259110

SCHEMBL3259110

Cn1ncc(C2=NOCC(CI)O2)c1SCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.39
MAPT P10636 2/20 0.39
PKM P14618 2/20 0.39
ALDH1A1 P00352 4/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
SMN1; SMN2 Q16637 6/20 0.31
RAB9A P51151 5/20 0.31
HPGD P15428 3/20 0.31
LMNA P02545 2/20 0.31
PPARG P37231 2/20 0.31
HTT P42858 2/20 0.31
NCOA2 Q15596 2/20 0.31
NCOA1 Q15788 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
KDM4E B2RXH2 2/20 0.31
MAPK1 P28482 2/20 0.31
AR P10275 1/20 0.31
NPC1 O15118 4/20 0.31
EGFR P00533 1/20 0.31

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
SCHEMBL3260152 0.86 MAPT (0.39) GAAMAPTPKMALDH1A1CYP3A4
SCHEMBL3258372 0.80 NPC1 (0.34) GAAMAPTPKMALDH1A1CYP3A4
SCHEMBL3259557 0.79 MAPT (0.35) GAAMAPTPKMALDH1A1CYP3A4
SCHEMBL8629590 0.78 MAPT (0.41) GAAMAPTPKMALDH1A1CYP3A4
SCHEMBL18215173 0.66 MAPT (0.50) GAAMAPTPKMALDH1A1SMN1; SMN2
SCHEMBL15542730 0.65 MAPT (0.42) GAAMAPTPKMALDH1A1SMN1; SMN2
SCHEMBL3259559 0.65 MAPT (0.34) GAAMAPTPKMALDH1A1SMN1; SMN2
SCHEMBL15554549 0.65 MAPT (0.41) GAAMAPTPKMALDH1A1SMN1; SMN2
SCHEMBL3258983 0.65 MAPT (0.35) GAAMAPTPKMALDH1A1CYP3A4
SCHEMBL23863535 0.65 MAPT (0.52) GAAMAPTPKMALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7709636-B2 Pyrazole sulfonylurea compound and herbicide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-05-04 US disclosed
US-7709636-B2 Pyrazole sulfonylurea compound and herbicide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-05-04 US disclosed
US-20100016584-A1 Pyrazole sulfonylurea compound and herbicide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-01-21 US disclosed
US-20100016584-A1 Pyrazole sulfonylurea compound and herbicide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-01-21 US disclosed
US-7557067-B2 Pyrazole sulfonylurea compound and herbicide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-07-07 US disclosed
US-7557067-B2 Pyrazole sulfonylurea compound and herbicide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-07-07 US disclosed
US-20080064600-A1 Pyrazole Sulfonylurea Compound and Herbicide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2008-03-13 US disclosed
US-20080064600-A1 Pyrazole Sulfonylurea Compound and Herbicide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2008-03-13 US disclosed
EP-1748047-A1 PYRAZOLE SULFONYLUREA COMPOUND AND HERBICIDE Nissan Chemical Industries, Ltd. (JP) 2007-01-31 EP 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 (2 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-20100016584-A1 Pyrazole sulfonylurea compound and herbicide PDXK, HCN3, SLC6A9 GAA 2575/4885MAPT 4591/4885PKM 703/4885
US-20080064600-A1 Pyrazole Sulfonylurea Compound and Herbicide GLP1R, MSRB3, PDXK GAA 2715/4885MAPT 4685/4885PKM 1156/4885

“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.