SCHEMBL8552022

SCHEMBL8552022

CCCCCCCCCCc1cnc(-c2ccc(-c3ccc4c(c3)CC(CCCCCCCC)C4)cc2F)nc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.41
RAB9A P51151 5/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
RARA P10276 1/20 0.38
RARG P13631 1/20 0.38
CYP3A4 P08684 2/20 0.36
CYP2C8 P10632 2/20 0.36
S1PR3 Q99500 2/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL8553340 0.93 RARB (0.42) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8552427 0.87 RARB (0.50) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8552162 0.87 RARB (0.50) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL7118001 0.87 RARB (0.50) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8788428 0.82 GPR119 (0.41) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8557226 0.80 MAPT (0.50) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8553176 0.79 CYP3A4 (0.46) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL8553142 0.78 RAB9A (0.55) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL9398937 0.78 RARB (0.39) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL9398930 0.78 RARB (0.39) RARBRAB9ASMN1; SMN2MAPTKDM4E

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