SCHEMBL17070644

SCHEMBL17070644

CCOc1ccc2cc(C3CCC(C)=CO3)c(F)c(F)c2c1F

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.32
SLC6A2 P23975 4/20 0.31
SLC6A4 P31645 4/20 0.31
SLC6A3 Q01959 2/20 0.31
KDM1A O60341 2/20 0.30
FGFR2 P21802 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
SCHEMBL17070637 0.86 KDM1A (0.33) ACE2SLC6A2SLC6A4SLC6A3KDM1A
SCHEMBL17068610 0.84 ACE2 (0.34) ACE2
SCHEMBL17070652 0.84 S1PR1 (0.31) ACE2SLC6A2SLC6A4SLC6A3KDM1A
SCHEMBL17070825 0.83
SCHEMBL17068692 0.80 GAA (0.31)
SCHEMBL17070642 0.78
SCHEMBL18015208 0.78 FGFR2 (0.32) KDM1AFGFR2
SCHEMBL19466345 0.77 KDM1A (0.32) KDM1AFGFR2
SCHEMBL17070645 0.76
SCHEMBL17070818 0.74

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-9523038-B2 Dihydropyran compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2016-12-20 US disclosed
US-20150252264-A1 DIHYDROPYRAN COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2015-09-10 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-20150252264-A1 DIHYDROPYRAN COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE DRD1, CNKSR1, DRG1 ACE2 471/4885SLC6A2 4619/4885SLC6A4 4260/4885

“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.