SCHEMBL874869

SCHEMBL874869

C[C@@H](C(=O)OP(=O)(O)Cl)N(OC1CCCCC1)c1cccc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 2/20 0.39
EPHX1 P07099 2/20 0.34
METAP2 P50579 6/20 0.33
METAP1 P53582 3/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL22341535 1.00 ACP3 (0.39) ACP3EPHX1METAP2METAP1MEN1
SCHEMBL781866 0.83 POLB (0.37) MEN1KMT2ALMNANPSR1
SCHEMBL472186 0.82 SIGMAR1 (0.35) ACP3MEN1KMT2A
SCHEMBL873042 0.82 KDM4E (0.35) ACP3
SCHEMBL472185 0.80 SIGMAR1 (0.33) ACP3KMT2A
SCHEMBL472204 0.80 ALDH1A1 (0.36) LMNA
SCHEMBL28173099 0.79 ACP3 (0.40) ACP3EPHX1METAP2METAP1MEN1
SCHEMBL874259 0.78 ALDH1A1 (0.33) ACP3KMT2A
SCHEMBL472191 0.77 ALDH1A1 (0.38) ACP3KMT2ALMNA
SCHEMBL12496458 0.74 CTSG (0.39) ACP3KMT2A

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
WO-2012040126-A1 SUBSTITUTED NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2012-03-29 WO disclosed