SCHEMBL18314844

SCHEMBL18314844

CCCc1ccc(-c2ccc(C(F)(F)Oc3cc(F)c(C(F)(F)Oc4ccc(OC(F)(F)C=C(F)F)c(F)c4)c(F)c3)c(F)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.33
S1PR1 P21453 1/20 0.33
RARB P10826 2/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30
RARA P10276 1/20 0.30
RARG P13631 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
SCHEMBL18315032 0.95 KIF11 (0.36) KIF11S1PR1RARBCYP11B1CYP11B2
SCHEMBL18314852 0.95 KIF11 (0.36) KIF11S1PR1RARBCYP11B1CYP11B2
SCHEMBL18315052 0.93 S1PR1 (0.34) S1PR1RARBRARARARG
SCHEMBL18315090 0.90 S1PR1 (0.33) S1PR1RARBRARARARG
SCHEMBL18314848 0.89 KIF11 (0.35) KIF11S1PR1RARB
SCHEMBL18315024 0.87 KIF11 (0.40) KIF11S1PR1RARBCYP11B1CYP11B2
SCHEMBL18315056 0.86 GRM2 (0.32) S1PR1
SCHEMBL18315079 0.86 KIF11 (0.38) KIF11RARBCYP11B1CYP11B2RARA
SCHEMBL18315059 0.86 KIF11 (0.38) KIF11RARBCYP11B1CYP11B2RARA
SCHEMBL18314816 0.85 S1PR1 (0.33) S1PR1

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-20160362605-A1 LIQUID CRYSTAL COMPOUND HAVING 1,1,3,3-TETRAFLUOROALLYLOXY GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2016-12-15 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-20160362605-A1 LIQUID CRYSTAL COMPOUND HAVING 1,1,3,3-TETRAFLUOROALLYLOXY GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE TCOF1, PIEZO1, RCC1 KIF11 912/4885S1PR1 3198/4885RARB 2668/4885

“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.