SCHEMBL9570577

SCHEMBL9570577

CCOc1ccc(C(CO)C(F)(F)F)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.43
MAPT P10636 4/20 0.40
RAB9A P51151 3/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ERN1 O75460 1/20 0.38
LMNA P02545 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
FAAH O00519 1/20 0.38
KMT2A Q03164 4/20 0.37
MEN1 O00255 2/20 0.37
POLB P06746 2/20 0.37
GAA P10253 1/20 0.37
MCL1 Q07820 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP2C19 P33261 3/20 0.36
NPC1 O15118 2/20 0.36

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
SCHEMBL9570629 0.84 KDM1A (0.40) L3MBTL1FAAHKMT2AMEN1NPSR1
SCHEMBL9570592 0.78 SLC6A2 (0.42) LMNASMN1; SMN2ALDH1A1CYP2D6
SCHEMBL16956208 0.78 RORC (0.49) RORCMAPTRAB9AATML3MBTL1
SCHEMBL9561666 0.77 NQO1 (0.50) MAPTL3MBTL1LMNAKMT2AMEN1
SCHEMBL16957715 0.77 MAPT (0.46) RORCMAPTRAB9AATML3MBTL1
SCHEMBL9560409 0.77 NQO1 (0.50) MAPTL3MBTL1LMNAKMT2AMEN1
SCHEMBL10555386 0.77 NQO1 (0.50) MAPTL3MBTL1LMNAKMT2AMEN1
SCHEMBL9570620 0.76 ERN1 (0.43) RORCMAPTRAB9AATML3MBTL1
SCHEMBL11951613 0.75 ALDH1A1 (0.48) RORCMAPTRAB9AATML3MBTL1
SCHEMBL9570831 0.74 PPARG (0.57) MAPTL3MBTL1LMNASMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0545891-A2 Aldehyde compounds and derivatives thereof useful as intermediates in the preparation of insectical ether compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-06-09 EP disclosed
US-4840971-A INSECTICIDES, MITICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-06-20 US disclosed
EP-0240978-A2 Ether compounds, process for their preparation, compositions containing the same and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-10-14 EP disclosed