SCHEMBL8575949

SCHEMBL8575949

CCOC(=O)C1(OC(=O)Cc2c(F)cccc2Cl)CCCC(OC)C1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.47
MEN1 O00255 5/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
GAA P10253 1/20 0.46
KDM4E B2RXH2 2/20 0.44
TSHR P16473 2/20 0.44
POLB P06746 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
ALDH1A1 P00352 5/20 0.43
TDP1 Q9NUW8 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALOX15 P16050 1/20 0.43
LMNA P02545 1/20 0.43
ATM Q13315 1/20 0.39
MAPT P10636 2/20 0.39
HTT P42858 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL8579077 0.93 KDM4E (0.39) KMT2AMEN1SMN1; SMN2GAAKDM4E
SCHEMBL8576979 0.89 KMT2A (0.49) KMT2AMEN1SMN1; SMN2GAAKDM4E
SCHEMBL8576766 0.85 SMN1; SMN2 (0.34) KMT2AMEN1SMN1; SMN2GAAKDM4E
SCHEMBL8578144 0.85 KMT2A (0.47) KMT2AMEN1SMN1; SMN2GAAKDM4E
SCHEMBL4488516 0.84 KDM4E (0.37) KMT2AMEN1SMN1; SMN2GAAKDM4E
SCHEMBL8578473 0.83 KMT2A (0.49) KMT2AMEN1SMN1; SMN2GAAKDM4E
SCHEMBL8577972 0.82 KMT2A (0.39) KMT2AMEN1SMN1; SMN2GAAKDM4E
SCHEMBL8578898 0.81 KMT2A (0.47) KMT2AMEN1SMN1; SMN2GAAKDM4E
SCHEMBL8576874 0.81 MEN1 (0.35) KMT2AMEN1GAAKDM4EPOLB
SCHEMBL8578556 0.81 KMT2A (0.47) KMT2AMEN1SMN1; SMN2GAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5719310-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1998-02-17 US disclosed
US-5610122-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-03-11 US disclosed