SCHEMBL16440937

SCHEMBL16440937

CCCc1ccc(COc2ccc(CCC)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
APP P05067 4/20 0.56
HRH3 Q9Y5N1 2/20 0.55
MAOB P27338 3/20 0.53
LTA4H P09960 1/20 0.52
EPHX2 P34913 1/20 0.52
FFAR1 O14842 1/20 0.51
BCHE P06276 1/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51

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
SCHEMBL16440936 0.94 FFAR1 (0.54) APPHRH3MAOBLTA4HEPHX2
SCHEMBL16428800 0.94 FFAR1 (0.54) APPHRH3MAOBLTA4HEPHX2
SCHEMBL13845303 0.92 APP (0.61) APPHRH3LTA4HEPHX2FFAR1
SCHEMBL19864469 0.92 MAOB (0.57) APPHRH3MAOBFFAR1SENP8
SCHEMBL10784840 0.92 LTA4H (0.64) HRH3MAOBLTA4HEPHX2FFAR1
SCHEMBL13845318 0.90 APP (0.62) APPHRH3MAOBFFAR1
SCHEMBL8039313 0.90 MAOB (0.62) APPHRH3MAOB
SCHEMBL16440939 0.90 MAOB (0.67) APPHRH3MAOBSENP8SENP7
SCHEMBL15196499 0.90 FFAR1 (0.61) APPMAOBLTA4HEPHX2FFAR1
Fluoride SCHEMBL9841526 0.89 HRH3 (0.48) APPHRH3MAOBLTA4HEPHX2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9957213-B2 Organic compound, liquid crystal composition, liquid crystal element, and liquid crystal display device SEMICONDUCTOR ENERGY LABORATORY CO. (JP) 2018-05-01 US disclosed
US-9957213-B2 Organic compound, liquid crystal composition, liquid crystal element, and liquid crystal display device SEMICONDUCTOR ENERGY LABORATORY CO. (JP) 2018-05-01 US disclosed
US-20150034870-A1 ORGANIC COMPOUND, LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL ELEMENT, AND LIQUID CRYSTAL DISPLAY DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-02-05 US disclosed
US-20150034870-A1 ORGANIC COMPOUND, LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL ELEMENT, AND LIQUID CRYSTAL DISPLAY DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-02-05 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-20150034870-A1 ORGANIC COMPOUND, LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL ELEMENT, AND LIQUID CRYSTAL DISPLAY DEVICE AR, OCIAD1, RCC2 APP 871/4885HRH3 415/4885MAOB 2243/4885

“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.