SCHEMBL417512

SCHEMBL417512

[O]C1Cc2ccc3cccc4c3c2C(C=C4)C1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL22283312 0.84 CYP3A4 (0.31) CYP3A4TSHR
SCHEMBL11795000 0.82 MTNR1A (0.30)
SCHEMBL14975752 0.81
SCHEMBL20209401 0.79 CYP1A2 (0.35) CYP3A4TSHR
SCHEMBL30365719 0.77 ADRA2A (0.36) CYP3A4TSHR
SCHEMBL29352264 0.77 ADRA2A (0.36) CYP3A4TSHR
SCHEMBL50690 0.77 ADRA2A (0.36) CYP3A4TSHR
Hydrochloric Acid SCHEMBL28386300 0.75 ADRA2A (0.35) CYP3A4TSHR
SCHEMBL10868983 0.73
SCHEMBL8674433 0.72 CYP3A4 (0.31) CYP3A4TSHR

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9117475-B2 Lubricant composition and use thereof FUJIFILM CORPORATION (JP) 2015-08-25 US disclosed
US-8828565-B2 Lubricant composition, fluorine-based compound, and use thereof FUJIFILM CORPORATION (JP) 2014-09-09 US disclosed
US-8477274-B2 Liquid crystal display device FUJIFILM CORPORATION (JP) 2013-07-02 US disclosed
US-20120231297-A1 LUBRICANT COMPOSITION, FLUORINE-BASED COMPOUND, AND USE THEREOF FUJIFILM CORPORATION (JP) 2012-09-13 US disclosed
US-8203675-B2 Liquid-crystal display device having retardation films with different optical anisotropy FUJIFILM CORPORATION (JP) 2012-06-19 US disclosed
US-8159639-B2 VA-mode liquid crystal display device FUJIFILM CORPORATION (JP) 2012-04-17 US disclosed
EP-2412789-A1 LUBRICANT COMPOSITION AND USE THEREOF FUJIFILM Corporation (JP) 2012-02-01 EP disclosed
US-20120021253-A1 LUBRICANT COMPOSITION AND USE THEREOF FUJIFILM CORPORATION (JP) 2012-01-26 US disclosed
US-7990502-B2 Liquid-crystal display device FUJIFILM CORPORATION (JP) 2011-08-02 US disclosed
US-7989576-B2 Triazine derivative, liquid crystal composition, anisotropic material, and liquid crystal display device using the same FUJIFILM CORPORATION (JP) 2011-08-02 US disclosed
US-20090018305-A1 TRIAZINE DERIVATIVE, LIQUID CRYSTAL COMPOSITION, ANISOTROPIC MATERIAL, AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME FUJIFILM CORPORATION (JP) 2009-01-15 US disclosed
WO-2009001952-A1 LIQUID-CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2008-12-31 WO disclosed
US-20080204644-A1 Liquid crystal display device FUJIFILM CORPORATION (JP) 2008-08-28 US disclosed
US-20080198303-A1 Polarizing plate and liquid crystal display device FUJIFILM CORPORATION (JP) 2008-08-21 US disclosed
US-20080192192-A1 Optical film and polarizing plate FUJIFILM CORPORATION (JP) 2008-08-14 US disclosed
US-20080174724-A1 Liquid crystal display device, optical film and polarizing plate FUJIFILM CORPORATION (JP) 2008-07-24 US disclosed
US-20080158488-A1 Liquid Crystal Display Device FUJIFILM CORPORATION (JP) 2008-07-03 US disclosed
US-20080158485-A1 Polarizing plate and liquid crystal display device FUJIFILM CORPORATION (JP) 2008-07-03 US disclosed
EP-1936431-A2 Liquid crystal display device FUJIFILM Corporation (JP) 2008-06-25 EP disclosed
WO-2007086538-A1 RETARDATION PLATE, POLARIZER PLATE, AND LIQUID CRYSTAL DISPLAY FUJIFILM CORPOTATION (JP) 2007-08-02 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 (3 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-20090018305-A1 TRIAZINE DERIVATIVE, LIQUID CRYSTAL COMPOSITION, ANISOTROPIC MATERIAL, AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME H1-0, H1-2, CHRM1 CYP3A4 1857/4885TSHR 284/4885
US-20120021253-A1 LUBRICANT COMPOSITION AND USE THEREOF MUC1, F12, SFN CYP3A4 3837/4885TSHR 4066/4885
US-20120231297-A1 LUBRICANT COMPOSITION, FLUORINE-BASED COMPOUND, AND USE THEREOF F12, F2, F11 CYP3A4 1534/4885TSHR 3889/4885

“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.