SCHEMBL12424992

SCHEMBL12424992

O=C1NC(c2cc(F)c(F)c(F)c2)=C2C(=O)NC(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)=C12

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
AKR1C1 Q04828 1/20 0.33
RXRA P19793 3/20 0.33
RXRB P28702 3/20 0.33
RXRG P48443 3/20 0.33
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
CES2 O00748 1/20 0.32
TDP2 O95551 1/20 0.31
PARP1 P09874 1/20 0.30
NOTUM Q6P988 2/20 0.30
DDB1 Q16531 1/20 0.30
CRBN Q96SW2 1/20 0.30

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
SCHEMBL12424970 0.90 RXRA (0.38) RXRARXRBRXRGCES2TDP2
SCHEMBL12424987 0.88 TDP2 (0.40) PDE3BPDE3ATDP2NOTUM
SCHEMBL12424985 0.87 NOTUM (0.41) AKR1C3AKR1C2RXRANOTUM
SCHEMBL12424859 0.86 CES2 (0.33) AKR1C3CES2
SCHEMBL12425001 0.86 NOTUM (0.32) AKR1C3AKR1C2AKR1C1RXRARXRB
SCHEMBL12424928 0.83 RXRA (0.41) RXRARXRBRXRGTDP2NOTUM
SCHEMBL12424982 0.83 RXRA (0.38) RXRARXRBRXRGTDP2
SCHEMBL12424995 0.82 TDP2 (0.43) RXRARXRBRXRGTDP2NOTUM
SCHEMBL12424976 0.79 NOTUM (0.44) RXRANOTUM
SCHEMBL12424977 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed