SCHEMBL9711769

SCHEMBL9711769

O=C1CCNC(=O)C1C(=O)c1ccccc1C(F)(F)F

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
SLC6A2 P23975 7/20 0.41
SLC6A4 P31645 7/20 0.41
SLC6A3 Q01959 4/20 0.41
CHRM4 P08173 1/20 0.38
CYP3A4 P08684 1/20 0.38
CHRM5 P08912 1/20 0.38
CYP2D6 P10635 1/20 0.38
CTNNB1 P35222 1/20 0.37
WNT3A P56704 1/20 0.37
MGLL Q99685 1/20 0.37

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
SCHEMBL9711573 0.83 CES2 (0.50) MEN1CYP1A2KMT2A
SCHEMBL9711563 0.83 KMT2A (0.38) MEN1CYP1A2KMT2A
SCHEMBL9711455 0.78 CES2 (0.42) KMT2A
SCHEMBL9711534 0.78 ITGB1 (0.38) MEN1KMT2ALMNA
SCHEMBL9711749 0.76 LMNA (0.38) LMNAGAASLC6A2SLC6A4SLC6A3
SCHEMBL9711619 0.75 PIN1 (0.48)
SCHEMBL9711702 0.74 BACE1 (0.49) MEN1KMT2AMGLL
SCHEMBL9711486 0.74 ALDH1A1 (0.44) MEN1KMT2AGAA
SCHEMBL9711517 0.74 HPD (0.46) MEN1KMT2A
SCHEMBL9711491 0.73 CES2 (0.49) MEN1KMT2ALMNA

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-5114461-A Herbicides MAY & BAKER LIMITED (GB) 1992-05-19 US disclosed
EP-0278742-A2 Cyclic diones MAY & BAKER LIMITED (GB) 1988-08-17 EP disclosed