SCHEMBL17014454

SCHEMBL17014454

Cc1ccc(OS(=O)(=O)C(F)(F)F)c2c1C1(CCC2)CCC1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.40
DRD3 P35462 8/20 0.40
HTR1D P28221 2/20 0.40
DRD4 P21917 6/20 0.39
HTR5A P47898 1/20 0.39
DRD1 P21728 4/20 0.39
DRD5 P21918 4/20 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
SCHEMBL17014449 0.96 DRD2 (0.39) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL17014326 0.94 DRD2 (0.39) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL17019663 0.91 DRD2 (0.40) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL17019699 0.85 DRD2 (0.40) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL17014496 0.83 DRD2 (0.37) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL17014405 0.83 DRD2 (0.36) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL17019619 0.82 DRD2 (0.40) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL12600417 0.79 RXRG (0.43) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL17014501 0.78 DRD2 (0.37) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL15746291 0.76 DRD2 (0.32) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150232509-A1 SPIRO RING COMPOUNDS AS HEPATITIS C VIRUS (HCV) INHIBITORS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-08-20 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 (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-20150232509-A1 SPIRO RING COMPOUNDS AS HEPATITIS C VIRUS (HCV) INHIBITORS HAVCR2, SLC10A1, SORD DRD2 3934/4885DRD3 2599/4885HTR1D 3262/4885

“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.