SCHEMBL20111084

SCHEMBL20111084

CCCCCC1CCC(c2ccc(-c3cc(F)c(OCF)c(F)c3)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.36
FFAR4 Q5NUL3 2/20 0.36
MAPT P10636 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
GAA P10253 1/20 0.35
SPHK1 Q9NYA1 6/20 0.34
HRH3 Q9Y5N1 1/20 0.33
ESR2 Q92731 1/20 0.33
RARA P10276 1/20 0.32
RARB P10826 1/20 0.32
DGAT1 O75907 1/20 0.32
SPHK2 Q9NRA0 2/20 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
SCHEMBL20111090 0.97 CYP2C9 (0.34) CYP2C9FFAR4MAPTMEN1KMT2A
SCHEMBL20111085 0.96 CYP2C9 (0.37) CYP2C9FFAR4MAPTMEN1KMT2A
SCHEMBL20111091 0.93 CYP2C9 (0.35) CYP2C9FFAR4MAPTMEN1KMT2A
SCHEMBL13128374 0.92 CYP2C9 (0.44) CYP2C9FFAR4MAPTMEN1KMT2A
SCHEMBL17072358 0.92 CYP2C9 (0.44) CYP2C9FFAR4MAPTMEN1KMT2A
SCHEMBL19542806 0.91 FFAR4 (0.37) CYP2C9FFAR4MAPTMEN1KMT2A
SCHEMBL19542792 0.91 FFAR4 (0.39) CYP2C9FFAR4MAPTMEN1KMT2A
SCHEMBL18310492 0.88 CYP2C9 (0.41) CYP2C9FFAR4MAPTMEN1KMT2A
SCHEMBL19542828 0.88 FFAR4 (0.36) CYP2C9FFAR4MAPTMEN1KMT2A
SCHEMBL20111087 0.88 MAPT (0.33) CYP2C9FFAR4MAPTMEN1KMT2A

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-20180119011-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2018-05-03 US disclosed