SCHEMBL14899706

SCHEMBL14899706

CC1CCC(N(CCOCc2ccccc2C(F)(F)F)C(N)=O)CC1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.42
SLC6A2 P23975 14/20 0.41
SLC6A4 P31645 14/20 0.41
IDO1 P14902 2/20 0.40
SLC6A3 Q01959 2/20 0.40
MAOA P21397 1/20 0.40
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TACR1 P25103 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
SCHEMBL9071933 1.00 MAOB (0.42) MAOBSLC6A2SLC6A4IDO1SLC6A3
SCHEMBL2668590 0.87 ALDH1A1 (0.41) MAOBALDH1A1
SCHEMBL9071949 0.87 ALDH1A1 (0.41) MAOBALDH1A1
SCHEMBL12204361 0.85 TRPM8 (0.39) MAOBSLC6A2SLC6A4SLC6A3KDM4E
SCHEMBL9071903 0.84 KMT2A (0.42) MAOBSLC6A2SLC6A4IDO1MAOA
SCHEMBL2669500 0.84 KMT2A (0.42) MAOBSLC6A2SLC6A4IDO1MAOA
SCHEMBL2668708 0.84 SLC6A2 (0.37) SLC6A2SLC6A4
SCHEMBL9071938 0.83 GAA (0.47) SLC6A2SLC6A4IDO1ALDH1A1
SCHEMBL14899708 0.83 TRPV1 (0.35) MAOBALDH1A1
SCHEMBL2668517 0.82 PYGL (0.41) KDM4EALDH1A1

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-1904467-B1 Urea glucokinase activators NOVO NORDISK AS (DK) 2013-05-01 EP disclosed