SCHEMBL3434829

SCHEMBL3434829

CSC(=O)NCC1CN(c2ccc(N3CCN(C(=O)c4cc(C)on4)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.56
MAOA P21397 5/20 0.56
LMNA P02545 1/20 0.56
PTGS1 P23219 1/20 0.56
CALML3 P27482 1/20 0.56
SDHA P31040 1/20 0.56
F10 P00742 10/20 0.52
TOP2B Q02880 1/20 0.47

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
SCHEMBL3395830 1.00 MAOB (0.56) MAOBMAOALMNAPTGS1CALML3
SCHEMBL14448238 0.91 MAOB (0.68) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3394853 0.91 MAOB (0.58) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3394862 0.90 MAOB (0.57) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3395522 0.89 MAOB (0.56) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3396443 0.88 MAOB (0.55) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3396414 0.87 MAOB (0.55) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3397714 0.86 MAOB (0.55) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3394641 0.85 MAOB (0.59) MAOBMAOALMNAPTGS1CALML3
SCHEMBL3392748 0.84 MAOB (0.58) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2170874-A2 NOVEL COMPOUNDS AND THEIR USE Orchid Research Laboratories Limited (IN) 2010-04-07 EP claimed
WO-2009001192-A2 NOVEL COMPOUNDS AND THEIR USE ORCHID RESEARCH LABORATORIES LIMITED (IN) 2008-12-31 WO claimed