SCHEMBL12822769

SCHEMBL12822769

COc1ccc(-c2ccc(-c3ccc(COc4ccc(C5CO5)c(F)c4)cc3)c(F)c2F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 5/20 0.43
▸ MAOB P27338 3/20 0.42
▸ PPARD Q03181 1/20 0.40
▸ NPC1 O15118 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ MAPT P10636 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ NOD2 Q9HC29 1/20 0.39
▸ ANO1 Q5XXA6 1/20 0.39
▸ APP P05067 2/20 0.39
▸ SPHK2 Q9NRA0 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SENP8 Q96LD8 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ F10 P00742 1/20 0.38

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
SCHEMBL13586513 0.91 F10 (0.38) FFAR1MAOBNPC1RAB9AMEN1
SCHEMBL13586515 0.89 FFAR1 (0.39) FFAR1MAOBSENP8SENP7SENP6
SCHEMBL12908284 0.88 FFAR1 (0.40) FFAR1MAOBPPARDMAPTMAPK1
SCHEMBL12823864 0.86 FFAR1 (0.40) FFAR1MAOBPPARDF10
SCHEMBL13586402 0.86 F10 (0.35) FFAR1MAOBF10
SCHEMBL12822690 0.86 MAOB (0.40) FFAR1MAOB
SCHEMBL12994390 0.86 FFAR1 (0.41) FFAR1MAOBPPARDMAPTMEN1
SCHEMBL13586502 0.86 F10 (0.36) FFAR1MAOBNPC1RAB9AMAPT
SCHEMBL13586391 0.86 FFAR1 (0.38) FFAR1MAOBF10
SCHEMBL12823910 0.84 SYK (0.39) FFAR1MAOBAPP

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-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
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 — — 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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, EFHD2 FFAR1 247/4885MAOB 3160/4885PPARD 3762/4885

“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.

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