SCHEMBL14219333

SCHEMBL14219333

C[C@@H](CC1CCC(CCC2CCC(c3cc(F)c(Cl)c(F)c3)CC2)CC1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.33
OPRL1 P41146 5/20 0.33
SLC6A2 P23975 4/20 0.33
SLC6A4 P31645 4/20 0.33
SLC6A3 Q01959 4/20 0.33
TAAR1 Q96RJ0 2/20 0.32
GRM2 Q14416 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
SCHEMBL14219592 1.00 IDO1 (0.33) IDO1OPRL1SLC6A2SLC6A4SLC6A3
SCHEMBL14219395 0.93 IDO1 (0.33) IDO1SLC6A2SLC6A4SLC6A3TAAR1
SCHEMBL14219605 0.90 IDO1 (0.34) IDO1SLC6A2SLC6A4SLC6A3TAAR1
SCHEMBL14219410 0.90 IDO1 (0.34) IDO1SLC6A2SLC6A4SLC6A3TAAR1
SCHEMBL14219334 0.88 SLC6A4 (0.38) IDO1OPRL1SLC6A2SLC6A4SLC6A3
SCHEMBL14219604 0.88 SLC6A4 (0.38) IDO1OPRL1SLC6A2SLC6A4SLC6A3
SCHEMBL14219602 0.86 PDPK1 (0.37) IDO1TAAR1
SCHEMBL14219464 0.86 APP (0.35) IDO1SLC6A2SLC6A4SLC6A3TAAR1
SCHEMBL14219416 0.85 APP (0.38) IDO1
SCHEMBL14219585 0.85 KDM4E (0.37) IDO1SLC6A2SLC6A4SLC6A3TAAR1

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