SCHEMBL12823232

SCHEMBL12823232

CCc1ccc(-c2ccc(COc3ccc(-c4ccc(C5CO5)cc4F)cc3)c(F)c2F)cc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 12/20 0.40
GYS1 P13807 2/20 0.36
GRM2 Q14416 1/20 0.35
FFAR1 O14842 3/20 0.34
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
MAOB P27338 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
NR1H4 Q96RI1 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
SCHEMBL13586614 0.96 FFAR4 (0.41) FFAR4GYS1GRM2FFAR1OPRM1
SCHEMBL12822641 0.92 FFAR4 (0.43) FFAR4GYS1FFAR1MAOB
SCHEMBL13654169 0.92 FFAR4 (0.41) FFAR4GYS1FFAR1OPRM1OPRD1
SCHEMBL13586619 0.88 FFAR4 (0.44) FFAR4GYS1FFAR1MAOB
SCHEMBL13654154 0.88 FFAR4 (0.39) FFAR4GYS1FFAR1OPRM1OPRD1
SCHEMBL12822850 0.85 FFAR4 (0.37) FFAR4GYS1FFAR1MAOBNPC1
SCHEMBL12823287 0.85 FFAR4 (0.37) FFAR4GYS1FFAR1MAOB
SCHEMBL13586291 0.85 RARB (0.34) FFAR4GRM2
SCHEMBL12823408 0.85 FFAR4 (0.37) FFAR4GYS1FFAR1MAOBNPC1
SCHEMBL12823794 0.85 FFAR4 (0.37) FFAR4GYS1FFAR1MAOBNPC1

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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2011-04-21 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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, EFHD2 FFAR4 546/4885GYS1 4252/4885GRM2 2666/4885

“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.