SCHEMBL14219586

SCHEMBL14219586

C[C@@H](Cc1ccc(-c2ccc(CCc3cc(F)c(Cl)c(F)c3)cc2)cc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.38
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
POLB P06746 1/20 0.37
SIGMAR1 Q99720 3/20 0.35
MDM2 Q00987 1/20 0.35
ACP3 P15309 1/20 0.35
GRIA4 P48058 2/20 0.34
ADRB1 P08588 4/20 0.34
ADRB3 P13945 4/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
MAOB P27338 1/20 0.34
KCNH2 Q12809 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL14219299 0.90 ACP3 (0.40) ESR1ESR2MDM2ACP3GRIA4
SCHEMBL14219358 0.90 ACP3 (0.40) ESR1ESR2MDM2ACP3GRIA4
SCHEMBL14219565 0.88 SIGMAR1 (0.40) SLC2A1ESR1ESR2POLBSIGMAR1
SCHEMBL14219896 0.88 SIGMAR1 (0.40) SLC2A1ESR1ESR2POLBSIGMAR1
SCHEMBL14219455 0.86 ESR1 (0.44) SLC2A1ESR1ESR2POLBSIGMAR1
SCHEMBL14219554 0.86 PDPK1 (0.40) SLC2A1ESR1ESR2POLBSIGMAR1
SCHEMBL14219895 0.86 PDPK1 (0.40) SLC2A1ESR1ESR2POLBSIGMAR1
SCHEMBL14219899 0.85 FFAR1 (0.42) SLC2A1ESR1ESR2POLBSIGMAR1
SCHEMBL14219365 0.85 ACP3 (0.37) ESR1ESR2MDM2ACP3GRIA4
SCHEMBL14219379 0.84 MEN1 (0.40) SLC2A1POLBSIGMAR1MDM2ADRB1

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