SCHEMBL8047261

SCHEMBL8047261

N#Cc1c(O)cccc1C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 9/20 0.50
PGR P06401 1/20 0.45
SLC22A12 Q96S37 1/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 3/20 0.38
MAPT P10636 2/20 0.38
CACNA1B Q00975 2/20 0.38
APBA1 Q02410 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GLA P06280 2/20 0.37
HPGD P15428 2/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B1 P14061 1/20 0.37
HSD17B2 P37059 1/20 0.37
P2RX7 Q99572 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL1906819 0.85 AR (0.43) ARSLC22A12KDM4EALDH1A1GAA
SCHEMBL18352625 0.80 ALDH1A1 (0.54) ARKDM4EALDH1A1GAAMAPT
SCHEMBL2285228 0.78 ALDH1A1 (0.50) ARKDM4EALDH1A1GAAMAPT
SCHEMBL646513 0.78 L3MBTL1 (0.44) ARPGRSLC22A12KDM4EALDH1A1
SCHEMBL7868327 0.78 AR (0.46) ARPGRSLC22A12
SCHEMBL1275083 0.76 SLC22A12 (0.55) ARSLC22A12KDM4EALDH1A1GAA
SCHEMBL18190631 0.76 CA1 (0.39) ARSLC22A12KDM4EALDH1A1GAA
SCHEMBL2417258 0.76 CUL4A (0.46) ARSLC22A12KDM4EALDH1A1GAA
SCHEMBL8118463 0.76 AR (0.46) ARSLC22A12KDM4EALDH1A1GAA
SCHEMBL1409424 0.76 AR (0.37) ARSLC22A12KDM4EALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0606858-B1 Liquid crystal compositions and liquid crystal display devices CHISSO CORP (JP) 2000-04-26 EP claimed
US-5985170-A OF SUPERTWISTED NEMATIC (STN) MODE, CYANOPHENOL, (TRIFLUOROMETHYL)CYANOPHENOL, AND CYANODIFLUOROPHENOL, CONTROLLING A VOLTAGE HOLDING RATIO CHISSO CORPORATION (JP) 1999-11-16 US claimed
EP-0606858-A1 Liquid crystal compositions and liquid crystal display devices CHISSO CORPORATION (JP) 1994-07-20 EP claimed
US-7160877-B2 Aliphatic nitrogen-containing 5-membered ring compound TANABE SEIYAKU CO., LTD. (JP) 2007-01-09 US disclosed
EP-0606858-B1 Liquid crystal compositions and liquid crystal display devices CHISSO CORP (JP) 2000-04-26 EP disclosed
US-5985170-A OF SUPERTWISTED NEMATIC (STN) MODE, CYANOPHENOL, (TRIFLUOROMETHYL)CYANOPHENOL, AND CYANODIFLUOROPHENOL, CONTROLLING A VOLTAGE HOLDING RATIO CHISSO CORPORATION (JP) 1999-11-16 US disclosed
US-5723065-A CONDENSED HETEROCYCLE AND AROMATIC AMINE, ALIPHATIC AMINE AND FLUOROCYANOPHENOL CHISSO CORPORATION (JP) 1998-03-03 US disclosed
EP-0606858-A1 Liquid crystal compositions and liquid crystal display devices CHISSO CORPORATION (JP) 1994-07-20 EP disclosed