SCHEMBL12907852

SCHEMBL12907852

CCCC(O)c1ccc(COc2ccc(-c3ccc(C4CO4)c(F)c3F)cc2)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ACACA Q13085 1/20 0.34
▸ FFAR1 O14842 1/20 0.34
▸ GYS1 P13807 3/20 0.33
▸ MAOB P27338 1/20 0.33
▸ PDE4A P27815 2/20 0.32
▸ PDE4B Q07343 2/20 0.32
▸ PDE4C Q08493 2/20 0.32
▸ PDE4D Q08499 2/20 0.32
▸ FFAR4 Q5NUL3 2/20 0.32
▸ APP P05067 2/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ S1PR1 P21453 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32

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
SCHEMBL12821216 0.92 MEN1 (0.33) PDE4APDE4BPDE4CPDE4DFFAR4
SCHEMBL12718885 0.92 MEN1 (0.33) PDE4APDE4BPDE4CPDE4DFFAR4
SCHEMBL13654164 0.89 ACACA (0.38) ACACAFFAR1GYS1MAOBFFAR4
SCHEMBL12718968 0.88 FFAR4 (0.36) ACACAFFAR1GYS1MAOBPDE4A
SCHEMBL12822825 0.88 FFAR4 (0.31) ACACAGYS1FFAR4
SCHEMBL12907025 0.87 PDE4A (0.32) PDE4APDE4BPDE4CPDE4D
SCHEMBL12823807 0.84 FFAR1 (0.35) FFAR1GYS1MAOBFFAR4
SCHEMBL10303206 0.84 FFAR1 (0.39) FFAR1GYS1MAOBAPPCYP2C19
SCHEMBL13654000 0.84 PDE4D (0.36) FFAR1PDE4APDE4BPDE4CPDE4D
SCHEMBL10303207 0.83 FFAR1 (0.39) FFAR1GYS1MAOBAPPCYP2C19

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-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2011-02-17 — — US disclosed
WO-2009125668-A1 TRICYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE チッソ株式会社 (JP) 2009-10-15 — — WO 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-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, L3MBTL3 ACACA 3202/4885FFAR1 681/4885GYS1 3774/4885

“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.

Send feedback