SCHEMBL18364503

SCHEMBL18364503

Cc1ccc(OS(=O)(=O)C(F)(F)F)c(C(F)(F)F)c1C

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.33
DRD3 P35462 4/20 0.33
DRD1 P21728 2/20 0.33
DRD4 P21917 2/20 0.33
DRD5 P21918 2/20 0.33
HTR1D P28221 2/20 0.33
EPAS1 Q99814 1/20 0.32
CXCR2 P25025 2/20 0.32
STS P08842 1/20 0.32
ESR2 Q92731 1/20 0.32
CXCR1 P25024 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
SCHEMBL18374895 0.84 DRD2 (0.35) DRD2DRD3DRD1DRD4DRD5
SCHEMBL19948194 0.80 DRD2 (0.41) DRD2DRD3DRD1DRD4DRD5
SCHEMBL15565904 0.78 DRD2 (0.32) DRD2DRD3DRD1DRD4DRD5
SCHEMBL6934553 0.76 MAPT (0.43) DRD2DRD3DRD1DRD4DRD5
SCHEMBL23250280 0.75 CXCR2 (0.35) DRD2DRD3DRD1DRD4DRD5
SCHEMBL29863304 0.75 CXCR2 (0.35) DRD2DRD3DRD1DRD4DRD5
SCHEMBL21620884 0.75 KDM4E (0.42) DRD2DRD3DRD1DRD4DRD5
Hydrogen Sulfide SCHEMBL27838727 0.75 MAPT (0.42) DRD2DRD3DRD1DRD4DRD5
SCHEMBL6938489 0.73 CYP1A2 (0.43) DRD2DRD3DRD1DRD4DRD5
SCHEMBL2989290 0.72 CA1 (0.44) DRD2DRD3DRD1DRD4DRD5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9783736-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2017-10-10 US disclosed
US-20170009137-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2017-01-12 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-20170009137-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CXCR1, BRAF, LEF1 DRD2 231/4885DRD3 203/4885DRD1 86/4885

“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.