SCHEMBL11234692

SCHEMBL11234692

Cc1c(F)c(F)cc(Oc2ncccc2C(=O)Nc2c(F)cc(F)cc2F)c1F

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
CYP2C19 P33261 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
MAPK8 P45983 1/20 0.41
MAPT P10636 1/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
GPR6 P46095 2/20 0.41
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL6452431 0.87 KMT2A (0.61) KMT2ACYP2C19KDM4EMEN1CYP1A2
SCHEMBL11247737 0.87 KMT2A (0.64) KMT2ACYP2C19KDM4EMEN1CYP1A2
SCHEMBL11250348 0.81 L3MBTL1 (0.50) KMT2AMEN1L3MBTL1MAPK8MAPT
SCHEMBL10970151 0.78 KMT2A (0.57) KMT2ACYP2C19KDM4EMEN1CYP1A2
SCHEMBL10973036 0.76 KMT2A (0.57) KMT2ACYP2C19KDM4EMEN1CYP1A2
SCHEMBL11238903 0.75 MET (0.45) KMT2ACYP2C19MAPK8MAPTPDE4A
SCHEMBL10971447 0.74 KMT2A (0.78) KMT2ACYP2C19KDM4EMEN1CYP1A2
SCHEMBL11243535 0.74 GPBAR1 (0.44) KMT2ACYP2C19KDM4EL3MBTL1MAPK8
SCHEMBL8780573 0.73 P2RY1 (0.48) KMT2ACYP2C19KDM4EMEN1CYP1A2
SCHEMBL27809949 0.70 RAB9A (0.52)

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
EP-0053011-A1 New herbicidal nicotinamide derivatives MAY & BAKER LIMITED (GB) 1982-06-02 EP disclosed