SCHEMBL97286

SCHEMBL97286

O=C1CCc2cccc(OS(=O)(=O)C(F)(F)F)c2N1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 0.41
DRD3 P35462 4/20 0.41
HTR1D P28221 2/20 0.41
KIF11 P52732 3/20 0.39
NPC1 O15118 1/20 0.38
MAPK13 O15264 1/20 0.38
MAPK12 P53778 1/20 0.38
MAPK11 Q15759 1/20 0.38
MAPK14 Q16539 1/20 0.38
DRD4 P21917 2/20 0.36
HTR5A P47898 1/20 0.36
SRD5A1 P18405 1/20 0.36

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
SCHEMBL29732306 0.78 ADRB2 (0.45) DRD2DRD3HTR1DKIF11NPC1
SCHEMBL96287 0.78 ADRB2 (0.45) DRD2DRD3HTR1DKIF11NPC1
SCHEMBL30042062 0.76 DRD2 (0.55) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL2071225 0.75 DRD2 (0.48) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL98343 0.74 HTR5A (0.50) HTR1DNPC1MAPK13MAPK12MAPK11
SCHEMBL99639 0.74 DRD2 (0.34) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL28442912 0.74 DRD2 (0.39) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL28436443 0.74 DRD2 (0.39) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL31448498 0.74 NPC1 (0.46) KIF11NPC1MAPK13MAPK12MAPK11
SCHEMBL2589591 0.73 DRD2 (0.50) DRD2DRD3HTR1DDRD4HTR5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362252-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-29 US disclosed
EP-1797082-B1 CARBOSTYRIL COMPOUND OTSUKA PHARMA CO LTD (JP) 2012-08-29 EP disclosed
EP-2426128-A1 Carbostyril compound Otsuka Pharmaceutical Co., Limited (JP) 2012-03-07 EP disclosed
US-20100261705-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2010-10-14 US disclosed
US-7777038-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-08-17 US disclosed
US-20070179173-A1 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-02 US 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-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 DRD2 947/4885DRD3 1453/4885HTR1D 2290/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 DRD2 947/4885DRD3 1453/4885HTR1D 2290/4885

“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.