SCHEMBL14449657

SCHEMBL14449657

CCCCCc1ccc(-c2ccc3c(c2)CCC(c2ccc(OCC)cc2)O3)cc1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SLC8A1 P32418 18/20 0.43
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41

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
SCHEMBL14449673 0.84 RAB9A (0.40) MAPTRAB9AL3MBTL1
SCHEMBL14449639 0.78 ESR1 (0.50) SLC8A1ESR1ESR2
SCHEMBL14449661 0.76 ESR1 (0.41) SLC8A1ESR1ESR2
SCHEMBL4605013 0.74 MAPT (0.69) MAPTRAB9AL3MBTL1ESR1
SCHEMBL14449550 0.74 RARB (0.37) MAPT
SCHEMBL14449544 0.73 S1PR1 (0.45) MAPT
SCHEMBL12285602 0.73 MAPT (0.68) MAPTRAB9AL3MBTL1ESR1
SCHEMBL9662959 0.73 MAPT (0.68) MAPTRAB9AL3MBTL1ESR1
SCHEMBL8754720 0.73 SPHK1 (0.45) MAPT
SCHEMBL14449680 0.71 RARB (0.39) SLC8A1ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7247355-B2 Liquid crystal compound having chroman ring, liquid crystal composition comprising the compound and liquid crystal display device comprising the composition CHISSO CORPORATION (JP) 2007-07-24 US disclosed