SCHEMBL23912017

SCHEMBL23912017

NN1CCC[C@@H](C(=O)N(N)c2ccccc2C(F)(F)F)C1=O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RBP4 P02753 2/20 0.38
▸ KDM4E B2RXH2 5/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ MAPT P10636 1/20 0.37
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ SLC6A2 P23975 1/20 0.34
▸ SLC6A4 P31645 1/20 0.34
▸ DPP4 P27487 1/20 0.34
▸ FAP Q12884 1/20 0.34
▸ DPP8 Q6V1X1 1/20 0.34
▸ DPP9 Q86TI2 1/20 0.34
▸ AKR1C3 P42330 1/20 0.34
▸ HCRTR1 O43613 1/20 0.34
▸ LMNA P02545 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL23642427 0.80 HPGD (0.35) MEN1KMT2ALMNA
SCHEMBL23642722 0.75 MEN1 (0.61) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL23642424 0.74 RBP4 (0.38) RBP4
SCHEMBL23912012 0.72 MGLL (0.38) DPP4
SCHEMBL12462449 0.70 RBP4 (0.47) RBP4MAPTMEN1KMT2ATDP1
SCHEMBL187797 0.70 RBP4 (0.47) RBP4MAPTMEN1KMT2ATDP1
SCHEMBL253085 0.68 CYP27A1 (0.44) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL194877 0.68 LMNA (0.41) ALDH1A1MEN1KMT2AL3MBTL1LMNA
SCHEMBL28595013 0.66 LMNA (0.40) KDM4EALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL909467 0.64 HCRTR1 (0.40) RBP4MEN1KMT2AHCRTR1

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-3601263-B1 NOVEL PYRIDAZINONE HERBICIDES FMC CORP (US) 2021-10-13 — — EP disclosed
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