SCHEMBL3377416

SCHEMBL3377416

CCCNC(=O)c1c(OS(=O)(=O)C(F)(F)F)cccc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.47
DRD3 P35462 4/20 0.47
HTR1D P28221 2/20 0.47
DRD4 P21917 1/20 0.43
HTR5A P47898 1/20 0.43
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
HCRTR1 O43613 2/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HIF1A Q16665 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MAPK1 P28482 1/20 0.37

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
SCHEMBL3378263 0.93 TSHR (0.47) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL3377423 0.91 DRD2 (0.44) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL3376179 0.88 DRD2 (0.39) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL3374780 0.87 POLB (0.39) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL3378393 0.86 CA12 (0.43) ALDH1A1CA12CA9HCRTR1PTGDR2
SCHEMBL3377281 0.86 CA12 (0.43) ALDH1A1CA12CA9HCRTR1PTGDR2
SCHEMBL3376132 0.85 POLB (0.43) DRD2DRD3HTR1DPOLBMEN1
SCHEMBL3378266 0.84 TSHR (0.50) DRD2DRD3HTR1DALDH1A1RXFP1
SCHEMBL3373446 0.82 MEN1 (0.45) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL3377816 0.81 KMT2A (0.39) DRD2DRD3HTR1DALDH1A1MEN1

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-1517886-B1 NOVEL PHTHALAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2010-11-10 EP disclosed
US-7132455-B2 Phthalamide derivatives BAYER CROPSCIENCE AG (DE) 2006-11-07 US disclosed
US-20060035967-A1 Novel phthalamide derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2006-02-16 US disclosed
EP-1517886-A1 NOVEL PHTHALAMIDE DERIVATIVES Bayer CropScience AG (DE) 2005-03-30 EP disclosed
WO-2004000796-A1 NOVEL PHTHALAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2003-12-31 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-20060035967-A1 Novel phthalamide derivatives HDAC1, HDAC2, CRY1 DRD2 2764/4885DRD3 2669/4885HTR1D 2541/4885

“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.