SCHEMBL1823124

SCHEMBL1823124

C[C@H](Nc1ccc(Cl)c(Cl)c1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 8/20 0.68
MME P08473 6/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
ACE P12821 3/20 0.50
CPA1 P15085 3/20 0.50
ACE2 Q9BYF1 3/20 0.50
CA1 P00915 1/20 0.47
CA2 P00918 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
SCHEMBL1824158 1.00 FPR2 (0.68) FPR2MMEMEN1KMT2AACE
SCHEMBL1823125 1.00 FPR2 (0.68) FPR2MMEMEN1KMT2AACE
SCHEMBL7677296 0.91 FPR2 (0.56) FPR2MEN1KMT2AACE
SCHEMBL7677287 0.91 FPR2 (0.56) FPR2MEN1KMT2AACE
SCHEMBL7673496 0.91 FPR2 (0.56) FPR2MEN1KMT2AACE
SCHEMBL4415553 0.90 NOS2 (0.58) FPR2CA1CA2
SCHEMBL4415551 0.90 NOS2 (0.58) FPR2CA1CA2
SCHEMBL7674471 0.90 NOS2 (0.58) FPR2CA1CA2
SCHEMBL1824098 0.84 GRN (0.61) FPR2MMECA1CA2
SCHEMBL1824097 0.84 GRN (0.61) FPR2MMECA1CA2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2123328-A1 Galanthamine derivatives, methods for their obtaining and use Sopharma AD (BG) 2009-11-25 EP claimed
EP-2123328-B1 Galanthamine derivatives, methods for their obtaining and use SOPHARMA AD (BG) 2011-05-04 EP disclosed
EP-2123328-A1 Galanthamine derivatives, methods for their obtaining and use Sopharma AD (BG) 2009-11-25 EP disclosed