SCHEMBL14219480

SCHEMBL14219480

C[C@@H](CC1CCC(c2ccc(CCc3cc(F)c(F)c(F)c3)cc2)CC1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.34
POLB P06746 1/20 0.33
SPHK1 Q9NYA1 2/20 0.32
APP P05067 1/20 0.31
DGAT1 O75907 1/20 0.31
TAAR1 Q96RJ0 2/20 0.31
FFAR4 Q5NUL3 1/20 0.31

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
SCHEMBL14219999 0.91 KDM1A (0.35) IDO1POLB
SCHEMBL14219496 0.91 KDM1A (0.35) IDO1POLB
SCHEMBL14219478 0.89 SPHK1 (0.34) IDO1POLBSPHK1
SCHEMBL14220002 0.89 HAT1 (0.32) IDO1POLB
SCHEMBL14219481 0.88 EP300 (0.35) IDO1POLB
SCHEMBL14219482 0.88 POLB (0.43) POLBDGAT1
SCHEMBL14219483 0.88 SLC6A4 (0.36) IDO1POLB
SCHEMBL14219487 0.87 FFAR4 (0.35) IDO1POLBSPHK1DGAT1FFAR4
SCHEMBL14220000 0.86 SPHK1 (0.34) IDO1POLBSPHK1FFAR4
SCHEMBL14219484 0.86 SPHK1 (0.34) IDO1POLBSPHK1FFAR4

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
EP-1650285-B1 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEM KK (JP) 2008-04-30 EP disclosed