SCHEMBL16882452

SCHEMBL16882452

FC(F)(F)c1cc(-c2c3ccccc3c(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3ccccc23)cc(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.49
CNR2 P34972 2/20 0.49
TDP1 Q9NUW8 1/20 0.45
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
KIF11 P52732 4/20 0.43
RXRA P19793 2/20 0.41
RXRB P28702 2/20 0.41
RXRG P48443 2/20 0.41
IKBKB O14920 1/20 0.41
ESR1 P03372 1/20 0.41
TACR1 P25103 2/20 0.40
DRD2 P14416 1/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
P2RX1 P51575 1/20 0.38
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
CYP1A1 P04798 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL31139502 0.98 CNR1 (0.47) CNR1CNR2TDP1ALDH1A1TSHR
SCHEMBL21344627 0.98 CNR1 (0.47) CNR1CNR2TDP1ALDH1A1TSHR
SCHEMBL22993192 0.94 TDP1 (0.49) CNR1CNR2TDP1ALDH1A1TSHR
SCHEMBL24037857 0.90 CNR1 (0.43) CNR1CNR2TDP1ALDH1A1TSHR
SCHEMBL24038260 0.88 ALOX5 (0.46) CNR1CNR2TDP1ALDH1A1TSHR
SCHEMBL24211024 0.86 NOTUM (0.42) CNR1CNR2TDP1ALDH1A1TSHR
SCHEMBL22978410 0.86 TDP1 (0.44) CNR1CNR2TDP1KIF11RXRA
SCHEMBL24605168 0.84 CYP1A2 (0.43) CNR1CNR2TDP1ALDH1A1TSHR
SCHEMBL22993088 0.84 CNR1 (0.42) CNR1CNR2TDP1ESR1P2RX1
SCHEMBL22978405 0.79 CNR2 (0.53) CNR2TDP1ALDH1A1TSHRKIF11

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-1009044-B1 Electroluminescent device with anthracene derivatives hole transport layer GLOBAL OLED TECHNOLOGY LLC (US) 2015-07-08 EP disclosed