SCHEMBL13610616

SCHEMBL13610616

O=C(CCCCS)OCC(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.42
FOLH1 Q04609 1/20 0.41
HDAC3 O15379 5/20 0.36
HDAC1 Q13547 5/20 0.36
HDAC2 Q92769 5/20 0.36
HDAC10 Q969S8 5/20 0.36
HDAC11 Q96DB2 5/20 0.36
HDAC8 Q9BY41 5/20 0.36
HDAC6 Q9UBN7 5/20 0.36
DGKA P23743 1/20 0.35
HDAC4 P56524 4/20 0.33
HDAC7 Q8WUI4 4/20 0.33
HDAC9 Q9UKV0 4/20 0.33
HDAC5 Q9UQL6 4/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
DNM1 Q05193 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL509013 0.89 HTT (0.50) HTTDGKAALDH1A1MEN1KMT2A
SCHEMBL6297122 0.87 HTT (0.48) HTTDGKAALDH1A1MEN1KMT2A
SCHEMBL13610599 0.85 HTT (0.46) HTTALDH1A1MEN1KMT2ATSHR
SCHEMBL5791835 0.85 HTT (0.50) HTTDGKAALDH1A1MEN1KMT2A
SCHEMBL2672061 0.83 FOLH1 (0.44) FOLH1HDAC3HDAC1HDAC2HDAC10
SCHEMBL13610614 0.82 ALDH1A1 (0.49) FOLH1DGKAALDH1A1MEN1KMT2A
SCHEMBL9449439 0.82 LMNA (0.46) HTTFOLH1HDAC11ALDH1A1MEN1
SCHEMBL4365200 0.82 FOLH1 (0.43) FOLH1HDAC3HDAC1HDAC2HDAC10
SCHEMBL11176296 0.82 FOLH1 (0.43) FOLH1HDAC3HDAC1HDAC2HDAC10
SCHEMBL2671886 0.82 FOLH1 (0.43) FOLH1HDAC3HDAC1HDAC2HDAC10

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 4 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-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
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 HTT 4033/4885FOLH1 4405/4885HDAC3 4478/4885

“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.