SCHEMBL8554332

SCHEMBL8554332

CCCCCCCCCCC1Cc2ccc(-c3ncc(OC(=O)c4ccc(F)cc4)cn3)cc2C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.40
KMT2A Q03164 4/20 0.40
MCHR1 Q99705 2/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
LMNA P02545 4/20 0.38
NFKB1 P19838 3/20 0.38
NFKB2 Q00653 3/20 0.38
RELA Q04206 3/20 0.38
NPC1 O15118 3/20 0.38
POLB P06746 1/20 0.37
CYP2C9 P11712 3/20 0.36
CYP2C19 P33261 3/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 2/20 0.36
RARB P10826 1/20 0.36
TSHR P16473 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
SCHEMBL8553157 0.81 RAB9A (0.42) MAPTKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL8556698 0.81 RAB9A (0.36) MAPTKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL8554131 0.80 RARB (0.52) MAPTKMT2AMCHR1SMN1; SMN2MEN1
SCHEMBL8553550 0.78 MCHR1 (0.37) MCHR1SMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL8542748 0.78 FYN (0.40) MAPTKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL8551722 0.78 FYN (0.40) MAPTKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL8553936 0.78 KMT2A (0.41) KMT2ASMN1; SMN2MEN1ALDH1A1NPC1
SCHEMBL8558587 0.77 FYN (0.36) MAPTKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL8552026 0.77 RAB9A (0.43) MAPTKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL8553224 0.76 NPC1 (0.45) MAPTSMN1; SMN2ALDH1A1HPGDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0546338-B1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KK (JP) 1998-02-04 EP disclosed
US-5385692-A Improved response CANON KABUSHIKI KAISHA (JP) 1995-01-31 US disclosed
EP-0546338-A1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KABUSHIKI KAISHA (JP) 1993-06-16 EP disclosed