SCHEMBL5721760

SCHEMBL5721760

CCc1ccc2c(c1-c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C=C(c1ccccc1)[CH]2

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TACR1 P25103 12/20 0.35
PTPN5 P54829 1/20 0.34
DRD2 P14416 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
AR P10275 1/20 0.33
GPBAR1 Q8TDU6 1/20 0.32

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
SCHEMBL5721196 0.91 DRD2 (0.35) CNR1CNR2RXRARXRBRXRG
SCHEMBL5721796 0.84 CNR1 (0.36) CNR1CNR2RXRARXRBRXRG
SCHEMBL5721276 0.82 RXRA (0.39) CNR1CNR2RXRARXRBRXRG
SCHEMBL5721772 0.82 KDM4E (0.31) TP53MAPT
SCHEMBL5721415 0.82 CNR1 (0.37) CNR1CNR2TDP1TACR1GPBAR1
SCHEMBL5721186 0.81 CNR1 (0.35) CNR1CNR2TDP1TACR1PTPN5
SCHEMBL5721573 0.81 CNR1 (0.34) CNR1CNR2TDP1TACR1PTPN5
SCHEMBL5721827 0.80 RXRA (0.35) CNR1CNR2RXRARXRBRXRG
SCHEMBL5721651 0.80 RXRA (0.35) CNR1CNR2RXRARXRBRXRG
SCHEMBL5721711 0.80 RXRA (0.32) RXRARXRBRXRG

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-1640377-A1 Metallocenes and catalyst compositions derived therefrom Exxonmobil Chemical Patents Inc. (US) 2006-03-29 EP disclosed