SCHEMBL23992001

SCHEMBL23992001

CC(=O)OP(=O)(O)N(CC1CN(c2ccc(N3C=NN(C)CC3)c(F)c2)C(=O)O1)C(C)=O

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.65
MAOB P27338 8/20 0.46
LMNA P02545 1/20 0.43
PTGS1 P23219 1/20 0.43
CALML3 P27482 1/20 0.43
SDHA P31040 1/20 0.43
F10 P00742 9/20 0.39
KCNH2 Q12809 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
SCHEMBL17034020 1.00 MAOA (0.65) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL17032466 0.94 MAOA (0.63) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL17034014 0.91 MAOA (0.70) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL17034022 0.89 MAOA (0.49) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL17032468 0.86 MAOA (0.66) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL17034012 0.84 MAOB (0.62) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL17032458 0.83 MAOA (0.48) MAOAMAOBLMNAPTGS1CALML3
Delpazolid SCHEMBL14354106 0.80 MAOA (0.77) MAOAMAOBLMNAPTGS1CALML3
Delpazolid SCHEMBL11969210 0.80 MAOA (0.77) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL17034013 0.80 MAOA (0.53) MAOAMAOBLMNAPTGS1CALML3

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-3107923-B1 WATER-SOLUBLE O-CARBONYL PHOSPHORAMIDATE PRODRUGS FOR THERAPEUTIC ADMINISTRATION SHANGHAI MICURX PHARMACEUTICAL CO LTD (CN) 2021-11-03 EP disclosed