SCHEMBL12424985

SCHEMBL12424985

O=C1NC(c2cc(F)c(F)c(F)c2)=C2C(=O)NC(c3cccc(C(F)(F)F)c3)=C12

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.41
PARP10 Q53GL7 1/20 0.40
PARP11 Q9NR21 1/20 0.40
MAPT P10636 1/20 0.39
XDH P47989 1/20 0.39
PRF1 P14222 1/20 0.39
AKR1C3 P42330 1/20 0.38
AKR1C2 P52895 1/20 0.38
RXRA P19793 1/20 0.38
STK10 O94804 1/20 0.38
SLK Q9H2G2 1/20 0.38
IDO1 P14902 1/20 0.38
PGR P06401 1/20 0.37
SCN2A Q99250 1/20 0.37
MAOB P27338 1/20 0.37

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
SCHEMBL12424903 0.90 NOTUM (0.48) NOTUMPARP10PARP11MAPTXDH
SCHEMBL12424976 0.88 NOTUM (0.44) NOTUMPARP10PARP11MAPTXDH
SCHEMBL12424992 0.87 AKR1C3 (0.33) NOTUMAKR1C3AKR1C2RXRA
SCHEMBL12424991 0.86 MAPT (0.42) NOTUMPARP10PARP11MAPTXDH
SCHEMBL12425000 0.84 TP53 (0.45) NOTUMPARP10PARP11MAPTXDH
SCHEMBL12424987 0.84 TDP2 (0.40) NOTUMMAPT
SCHEMBL12424979 0.84 PARP10 (0.46) NOTUMPARP10PARP11MAPTXDH
SCHEMBL12424860 0.81 PTGS2 (0.44) XDHAKR1C2MAOB
SCHEMBL12424859 0.80 CES2 (0.33) AKR1C3
SCHEMBL12425048 0.78 TSHR (0.33)

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