SCHEMBL6690592

SCHEMBL6690592

CCCCCCCCCCCC=CC=COc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.45
FAAH O00519 6/20 0.43
PPARA Q07869 2/20 0.43
SOAT2 O75908 1/20 0.42
SOAT1 P35610 1/20 0.42
ALDH1A1 P00352 2/20 0.42
TSHR P16473 1/20 0.42
LTA4H P09960 2/20 0.41
EPHX2 P34913 2/20 0.40
PPARG P37231 1/20 0.40
CNR1 P21554 2/20 0.40
MLNR O43193 1/20 0.40
NR1I2 O75469 1/20 0.40
ESR1 P03372 1/20 0.40
NR3C1 P04150 1/20 0.40
PGR P06401 1/20 0.40
ADRB2 P07550 1/20 0.40
CHRM2 P08172 1/20 0.40
ADRB1 P08588 1/20 0.40
HTR1A P08908 1/20 0.40

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
SCHEMBL8601466 0.90 LTA4H (0.47) FAAHPPARASOAT2SOAT1ALDH1A1
SCHEMBL31106429 0.90 LTA4H (0.47) FAAHPPARASOAT2SOAT1ALDH1A1
SCHEMBL28710286 0.90 LTA4H (0.47) FAAHPPARASOAT2SOAT1ALDH1A1
SCHEMBL29653962 0.88 LTA4H (0.46) FAAHPPARASOAT2SOAT1ALDH1A1
SCHEMBL2369656 0.81 PPARA (0.43) FASNFAAHPPARAALDH1A1TSHR
SCHEMBL28819472 0.80 CNR1 (0.44) FAAHCNR1CNR2
SCHEMBL10639345 0.79 LTA4H (0.46) FAAHPPARASOAT2SOAT1ALDH1A1
SCHEMBL1720912 0.79 LTA4H (0.46) FAAHPPARASOAT2SOAT1ALDH1A1
SCHEMBL6036675 0.79 LTA4H (0.46) FAAHPPARASOAT2SOAT1ALDH1A1
SCHEMBL10420432 0.79 LTA4H (0.46) FAAHPPARASOAT2SOAT1ALDH1A1

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
WO-2004111092-A1 MODIFIED ALGINIC ACID OR ALGINIC ACID DERIVATIVES AND THERMOSETTING ANTI-REFLECTIVE COMPOSITIONS THEREOF AZ ELECTRONIC MATERIALS USA CORP. (US) 2004-12-23 WO disclosed