SCHEMBL9745392

SCHEMBL9745392

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

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.41
MAOB P27338 1/20 0.38
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
ATM Q13315 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALOX15 P16050 2/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 1/20 0.35
CYP19A1 P11511 1/20 0.35
MLYCD O95822 2/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL9745691 0.82 ELANE (0.45) ELANEMAOBHDAC1HDAC2ATM
SCHEMBL9747390 0.79 ELANE (0.46) ELANEMAOBATML3MBTL1TDP1
SCHEMBL9746046 0.77 ELANE (0.46) ELANEATML3MBTL1TDP1ALOX15
SCHEMBL9745633 0.75 ELANE (0.45) ELANEATML3MBTL1TDP1ALOX15
SCHEMBL9746229 0.75 ELANE (0.49) ELANEATML3MBTL1TDP1ALOX15
SCHEMBL9746277 0.75 ELANE (0.45) ELANEATML3MBTL1TDP1ALOX15
SCHEMBL9745988 0.75 ELANE (0.49) ELANEATML3MBTL1TDP1ALOX15
SCHEMBL9746034 0.75 ELANE (0.41) ELANEATML3MBTL1TDP1ALOX15
SCHEMBL9746583 0.74 ELANE (0.47) ELANEATML3MBTL1TDP1ALOX15
SCHEMBL9746037 0.73 ELANE (0.41) ELANEATML3MBTL1TDP1ALOX15

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