SCHEMBL9745691

SCHEMBL9745691

C=C(C(=O)Oc1ccccc1)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.45
MAOB P27338 1/20 0.41
CES1 P23141 2/20 0.41
ATM Q13315 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MLYCD O95822 1/20 0.38
BCHE P06276 1/20 0.38
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
NSD2 O96028 1/20 0.37
GAA P10253 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
SCHEMBL9747390 0.85 ELANE (0.46) ELANEMAOBATML3MBTL1TDP1
SCHEMBL9746046 0.82 ELANE (0.46) ELANEATML3MBTL1TDP1HPGD
SCHEMBL9745392 0.82 ELANE (0.41) ELANEMAOBATML3MBTL1TDP1
SCHEMBL13888377 0.81 TDP1 (0.39) ELANEMAOBATMTDP1KDM4E
SCHEMBL9745988 0.81 ELANE (0.49) ELANEATML3MBTL1TDP1HPGD
SCHEMBL9746229 0.81 ELANE (0.49) ELANEATML3MBTL1TDP1HPGD
SCHEMBL9746277 0.81 ELANE (0.45) ELANEATML3MBTL1TDP1HPGD
SCHEMBL2606420 0.81 PTPN5 (0.47) TDP1HDAC1HDAC2MAPTGAA
SCHEMBL2604658 0.80 LMNA (0.43) TDP1HDAC1HDAC2HPGDKDM4E
SCHEMBL9746583 0.79 ELANE (0.47) ELANEATML3MBTL1TDP1HPGD

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
US-5100762-A Radiation-sensitive polymer and radiation-sensitive composition containing the same MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1992-03-31 US disclosed