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SCHEMBL7709846

SCHEMBL7709846

CCOC(=O)N1CCN(c2ccc(N3CC(CNC(=S)C(C)C)OC3=O)cc2F)CC1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 7/20 0.59
▸ MAOA P21397 4/20 0.59
▸ LMNA P02545 1/20 0.59
▸ PTGS1 P23219 1/20 0.59
▸ CALML3 P27482 1/20 0.59
▸ SDHA P31040 1/20 0.59
▸ F10 P00742 10/20 0.54
▸ TOP2B Q02880 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL7709843 1.00 MAOB (0.59) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7712594 0.94 MAOB (0.57) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7712602 0.94 MAOB (0.57) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7712599 0.94 MAOB (0.57) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7710503 0.93 MAOB (0.60) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7710508 0.93 MAOB (0.60) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7710203 0.92 MAOB (0.59) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7710202 0.92 MAOB (0.59) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7710280 0.92 MAOB (0.65) MAOBMAOALMNAPTGS1CALML3
SCHEMBL7710119 0.92 MAOB (0.62) MAOBMAOALMNAPTGS1CALML3

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
US-6362189-B1 GRAMNEGATIVE, GRAMPOSITIVE BACTERIA PHARMACIA AND UPJOHN COMPANY 2002-03-26 — — US claimed