SCHEMBL25826340

SCHEMBL25826340

Cc1c(C(F)(F)F)cc(CC#N)cc1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
KDM4E B2RXH2 5/20 0.36
TDP1 Q9NUW8 1/20 0.36
AR P10275 9/20 0.35
ALDH1A1 P00352 3/20 0.35
GLA P06280 3/20 0.35
GAA P10253 3/20 0.35
HPGD P15428 3/20 0.35
TP53 P04637 1/20 0.35
PYCR1 P32322 1/20 0.33
PTPRC P08575 1/20 0.33
PTPN1 P18031 1/20 0.33
MEN1 O00255 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
KMT2A Q03164 1/20 0.32
HDAC1 Q13547 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL25826331 0.89 RXRA (0.34) RXRARXRBRXRGKDM4ETDP1
SCHEMBL24147891 0.82 RXRA (0.38) RXRARXRBRXRGKDM4ETDP1
SCHEMBL25985314 0.82 RXRA (0.38) RXRARXRBRXRGKDM4ETDP1
SCHEMBL25826329 0.80 KDM4E (0.44) KDM4ETDP1ARALDH1A1GLA
SCHEMBL24146616 0.80 KDM4E (0.42) RXRARXRBRXRGKDM4ETDP1
SCHEMBL20214380 0.79 CTSS (0.41) RXRARXRBRXRGARPYCR1
SCHEMBL26312438 0.77 PYCR1 (0.38) RXRARXRBRXRGKDM4ETDP1
SCHEMBL26312453 0.77 ALDH1A1 (0.42) RXRARXRBRXRGKDM4ETDP1
SCHEMBL25826351 0.77 AR (0.35) RXRARXRBRXRGKDM4EAR
SCHEMBL8882398 0.76 RXRA (0.43) RXRARXRBRXRGKDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230240138-A1 Organic Electronic Device and Display Device Comprising the Organic Electronic Device as Well as a Composition for Use in Organic Electronic Devices NOVALED GMBH (DE) 2023-07-27 US disclosed
US-20230232712-A1 Organic Electronic Device and Display Device Comprising the Organic Electronic Device as Well as a Composition for Use in Organic Electronic Devices NOVALED GMBH (DE) 2023-07-20 US disclosed