SCHEMBL6295529

SCHEMBL6295529

O=C1CC(C2CC3C(=O)OC(=O)C3c3cc(C(F)(F)F)ccc32)C(=O)O1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.40
CHRNB2 P17787 2/20 0.38
CHRNA4 P43681 2/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
TERT O14746 1/20 0.35
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SRD5A1 P18405 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
NOS3 P29474 1/20 0.30
NOS1 P29475 1/20 0.30
NOS2 P35228 1/20 0.30
DPP4 P27487 1/20 0.30
IDO1 P14902 1/20 0.30
PTGDR2 Q9Y5Y4 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
SCHEMBL12798565 0.89 ALDH1A1 (0.41) ALDH1A1
SCHEMBL6295676 0.84 HTR2A (0.35) CHRNB2CHRNA4CHRNB4CHRNA3HTR2A
SCHEMBL12158803 0.82 ALDH1A1 (0.39) CHRNB2CHRNA4MEN1KMT2AALDH1A1
SCHEMBL351607 0.82 ALDH1A1 (0.39) CHRNB2CHRNA4TERTMEN1KMT2A
SCHEMBL6301506 0.81 BCL2L1 (0.32) CA2ALDH1A1
SCHEMBL13207412 0.81
SCHEMBL23395844 0.79 ALDH1A1 (0.31) MEN1KMT2AHTR2AALDH1A1
SCHEMBL257601 0.79 ALDH1A1 (0.31) MEN1KMT2AHTR2AALDH1A1
SCHEMBL15935547 0.79 ALDH1A1 (0.31) MEN1KMT2AHTR2AALDH1A1
SCHEMBL12158802 0.79 ALDH1A1 (0.44) MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887534-B2 Liquid crystal aligning agent, method of forming a liquid crystal alignment film and liquid crystal display element JSR CORPORATION (JP) 2005-05-03 US claimed
US-8399068-B2 Liquid crystal aligning agent, method of producing a liquid crystal alignment film and liquid crystal display device JSR CORPORATION (JP) 2013-03-19 US disclosed
US-8399068-B2 Liquid crystal aligning agent, method of producing a liquid crystal alignment film and liquid crystal display device JSR CORPORATION (JP) 2013-03-19 US disclosed
US-8304031-B2 Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display device JSR CORPORATION (JP) 2012-11-06 US disclosed
US-8304031-B2 Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display device JSR CORPORATION (JP) 2012-11-06 US disclosed
US-20110118422-A1 LIQUID CRYSTAL ALIGNING AGENT, METHOD OF PRODUCING A LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY DEVICE JSR CORPORATION (JP) 2011-05-19 US disclosed
US-20110118422-A1 LIQUID CRYSTAL ALIGNING AGENT, METHOD OF PRODUCING A LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY DEVICE JSR CORPORATION (JP) 2011-05-19 US disclosed
US-20110105700-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY DEVICE JSR CORPORATION (JP) 2011-05-05 US disclosed
US-20110105700-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY DEVICE JSR CORPORATION (JP) 2011-05-05 US disclosed
US-7787085-B2 Optical alignment method and liquid crystal display element JSR CORPORATION (JP) 2010-08-31 US disclosed
US-7787085-B2 Optical alignment method and liquid crystal display element JSR CORPORATION (JP) 2010-08-31 US disclosed
US-20080123046-A1 OPTICAL ALIGNMENT METHOD AND LIQUID CRYSTAL DISPLAY ELEMENT JSR CORPORATION (JP) 2008-05-29 US disclosed
US-20080123046-A1 OPTICAL ALIGNMENT METHOD AND LIQUID CRYSTAL DISPLAY ELEMENT JSR CORPORATION (JP) 2008-05-29 US disclosed