SCHEMBL8649869

SCHEMBL8649869

COC(=O)C(=COCF)c1ccccc1C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ERCC5 P28715 1/20 0.40
FEN1 P39748 1/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPK1 P28482 1/20 0.38
GAA P10253 1/20 0.38
DHODH Q02127 1/20 0.38
LMNA P02545 1/20 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
SCHEMBL8649867 1.00 HPGD (0.41) HPGDL3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL7698025 0.85 LMNA (0.47) HPGDL3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL7516474 0.85 LMNA (0.47) HPGDL3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL1426471 0.83 NPC1 (0.43) HPGDL3MBTL1SMN1; SMN2ERCC5FEN1
SCHEMBL5998808 0.83 NPC1 (0.43) HPGDL3MBTL1SMN1; SMN2ERCC5FEN1
SCHEMBL1426474 0.83 NPC1 (0.43) HPGDL3MBTL1SMN1; SMN2ERCC5FEN1
SCHEMBL8765316 0.83 RECQL (0.41)
SCHEMBL8649235 0.83 RECQL (0.41)
SCHEMBL8648785 0.82 KDM4E (0.38) HPGDL3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL8648789 0.82 KDM4E (0.38) HPGDL3MBTL1SMN1; SMN2KDM4ETDP1

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
US-5710314-A FUNGICIDES OR INSECTICIDES OF AROMATIC ETHERS WITH ESTER GROUPS OR AMIDES NOVARTIS CORPORATION (US) 1998-01-20 US disclosed
EP-0784606-A1 MICROBICIDES Novartis AG (CH) 1997-07-23 EP disclosed
WO-1996010556-A1 MICROBICIDES NOVARTIS AG (CH) 1996-04-11 WO disclosed