SCHEMBL14261997

SCHEMBL14261997

CCCCCCOc1cc(F)c(OCCCC)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.40
THRA P10827 3/20 0.39
THRB P10828 3/20 0.39
NR5A1 Q13285 1/20 0.39
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
S1PR2 O95136 1/20 0.36
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
LPAR2 Q9HBW0 1/20 0.36
TLR8 Q9NR97 1/20 0.36
FAAH O00519 6/20 0.36
MEN1 O00255 1/20 0.36
NR1I2 O75469 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL8067639 0.80 L3MBTL1 (0.42) L3MBTL1THRATHRBTLR8FAAH
SCHEMBL17208951 0.80 TSHR (0.41) THRATHRBNR5A1TLR8
SCHEMBL19160350 0.78 NR5A1 (0.50) L3MBTL1THRATHRBNR5A1MEN1
SCHEMBL19160763 0.78 NR5A1 (0.50) L3MBTL1THRATHRBNR5A1MEN1
SCHEMBL19160557 0.78 NR5A1 (0.50) L3MBTL1THRATHRBNR5A1MEN1
SCHEMBL9685171 0.78 NR5A1 (0.44) THRATHRBNR5A1LPAR2
SCHEMBL28716497 0.78 NR5A1 (0.44) THRATHRBNR5A1LPAR2
SCHEMBL9683848 0.78 NR5A1 (0.44) THRATHRBNR5A1LPAR2
SCHEMBL9684782 0.78 NR5A1 (0.44) THRATHRBNR5A1LPAR2
SCHEMBL9684001 0.78 NR5A1 (0.44) THRATHRBNR5A1LPAR2

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-9059410-B2 Liquid crystalline organic semiconductor material and organic semiconductor device using same NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2015-06-16 US disclosed
US-20080058544-A1 Liquid crystalline organic semiconductor material and organic semiconductor device using same NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2008-03-06 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-20080058544-A1 Liquid crystalline organic semiconductor material and organic semiconductor device using same SLCO4C1, SLCO2A1, SLCO1A2 L3MBTL1 1984/4885THRA 4509/4885THRB 4729/4885

“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.