SCHEMBL12740600

SCHEMBL12740600

C=CCCOc1ccc(COc2ccc(-c3ccc(-c4ccc(C)cc4)c(F)c3F)cc2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 9/20 0.41
▸ FFAR4 Q5NUL3 4/20 0.41
▸ MAOB P27338 1/20 0.36
▸ PDCD1 Q15116 1/20 0.36
▸ CD274 Q9NZQ7 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ GRM5 P41594 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ CYP2C9 P11712 2/20 0.35
▸ MOGAT2 Q3SYC2 2/20 0.35
▸ DRD2 P14416 1/20 0.34
▸ DRD4 P21917 1/20 0.34
▸ DRD3 P35462 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ GYS1 P13807 1/20 0.34
▸ NMT1 P30419 1/20 0.34
▸ GSK3B P49841 1/20 0.34
▸ BACE1 P56817 1/20 0.34

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
SCHEMBL12737139 0.96 FFAR1 (0.39) FFAR1FFAR4MAOBPDCD1CD274
SCHEMBL12740603 0.94 FFAR1 (0.40) FFAR1FFAR4MAOBGRM5MAPK14
SCHEMBL14766862 0.91 S1PR1 (0.38) FFAR1FFAR4MAOBCYP2C9NPC1
SCHEMBL14767167 0.91 FFAR1 (0.42) FFAR1FFAR4MAOBPDCD1CD274
SCHEMBL12737140 0.90 FFAR1 (0.39) FFAR1FFAR4MAOBGRM5CYP2C9
SCHEMBL12740598 0.89 FFAR1 (0.42) FFAR1FFAR4MAOBGRM5NPC1
SCHEMBL10302537 0.88 GRM5 (0.38) FFAR1FFAR4MAOBPDCD1CD274
SCHEMBL12740185 0.88 FFAR1 (0.40) FFAR1FFAR4MAOBCYP2C9MOGAT2
SCHEMBL14765917 0.87 S1PR1 (0.39) FFAR1FFAR4MAOBCYP2C9NPC1
SCHEMBL14766225 0.87 FFAR1 (0.41) FFAR1FFAR4MAOBGYS1

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 — — US disclosed
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 FFAR1 247/4885FFAR4 546/4885MAOB 3160/4885

“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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