SCHEMBL13610607

SCHEMBL13610607

O=C(CCS)OCC(F)(F)C(F)(F)C(F)(F)C(F)F

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
USP2 O75604 1/20 0.40
MAPT P10636 1/20 0.40
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
XBP1 P17861 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL13610609 0.94 TSHR (0.47) TSHRUSP2MAPTPOLBGAA
SCHEMBL13610617 0.90 TSHR (0.35) TSHRUSP2MAPTPOLBGAA
SCHEMBL6259578 0.90 TSHR (0.40) TSHRUSP2MAPTPOLBGAA
SCHEMBL5946669 0.88 TSHR (0.39) TSHRUSP2MAPTPOLBGAA
SCHEMBL13610611 0.86 TSHR (0.38) TSHRUSP2MAPTGAAKDM4E
SCHEMBL19531998 0.86 TSHR (0.38) TSHRUSP2MAPTPOLBGAA
SCHEMBL19531997 0.85 TSHR (0.38) TSHRUSP2MAPTPOLBGAA
SCHEMBL9560652 0.83 TSHR (0.37) TSHRUSP2MAPTPOLBGAA
SCHEMBL2542553 0.82 TSHR (0.40) TSHRUSP2MAPTPOLBGAA
SCHEMBL13610601 0.82

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-7623751-B2 Compound, polymerizable composition, optical device, and method for producing refractive index profile optical device FUJIFILM CORPORATION (JP) 2009-11-24 US disclosed
US-20080226244-A1 Compound, Polymerizable Composition, Optical Device, and Method for Producing Refractive Index Profile Optical Device FUJIFILM CORPORATION (JP) 2008-09-18 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-20080226244-A1 Compound, Polymerizable Composition, Optical Device, and Method for Producing Refractive Index Profile Optical Device PIEZO1, PFN1, INF2 TSHR 2398/4885USP2 4518/4885MAPT 2002/4885

“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.