SCHEMBL1582797

SCHEMBL1582797

CCC(F)CC(Br)CC(F)COc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
MAOA P21397 1/20 0.41
PTGS1 P23219 1/20 0.41
SCN4A P35499 2/20 0.40
LTA4H P09960 2/20 0.38
MTNR1A P48039 3/20 0.37
MTNR1B P49286 3/20 0.37
CYP2D6 P10635 2/20 0.37
ADRB2 P07550 1/20 0.37
ADRB1 P08588 1/20 0.37
ADRB3 P13945 1/20 0.37
POLB P06746 1/20 0.35
FFAR1 O14842 1/20 0.35
KCNA3 P22001 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA7 P36544 1/20 0.35
CHRNA4 P43681 1/20 0.35

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
SCHEMBL8705465 0.92 LMNA (0.46) LMNAMAOAPTGS1SCN4ALTA4H
SCHEMBL28025665 0.90 LMNA (0.50) LMNAMAOAPTGS1SCN4ALTA4H
SCHEMBL17425093 0.86 LMNA (0.53) LMNAMAOAPTGS1SCN4ALTA4H
SCHEMBL1582921 0.83 LTA4H (0.44) LMNAMAOAPTGS1SCN4ALTA4H
SCHEMBL9149997 0.80 LTA4H (0.43) LMNAMAOAPTGS1LTA4HADRB2
SCHEMBL17009054 0.78 LMNA (0.53) LMNAMAOAPTGS1SCN4ALTA4H
SCHEMBL7101433 0.74 LMNA (0.48) LMNAMAOAPTGS1SCN4AMTNR1A
SCHEMBL28527689 0.74 LMNA (0.52) LMNAMAOAPTGS1SCN4AMTNR1A
SCHEMBL27688895 0.73 LMNA (0.52) LMNAMAOAPTGS1SCN4ALTA4H
SCHEMBL27548952 0.72 LMNA (0.50) LMNAMAOAPTGS1SCN4AMTNR1A

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-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
EP-1894984-B1 Liquid crystalline organic semiconductor material and organic semiconductor device using same NAT INST OF ADVANCED IND SCIEN (JP) 2011-04-20 EP 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
EP-1894984-A1 Liquid crystalline organic semiconductor material and organic semiconductor device using same National Institute of Advanced Industrial Science and Technology (JP) 2008-03-05 EP 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 LMNA 2564/4885MAOA 2115/4885PTGS1 4866/4885

“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.