SCHEMBL5070931

SCHEMBL5070931

COc1cc(C(=O)NCCCOCC(C)C)cnc1C(=O)NCC(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
STAMBP O95630 1/20 0.44
KMT2A Q03164 6/20 0.43
MEN1 O00255 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GAA P10253 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
GLA P06280 1/20 0.41
BRD4 O60885 1/20 0.41

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
SCHEMBL965095 0.91 MAPT (0.48) STAMBPKMT2AMEN1L3MBTL1GAA
SCHEMBL14735698 0.84 MAPT (0.46) KMT2AMEN1GAAMAPT
SCHEMBL5146388 0.82 SMPD1 (0.41) STAMBPKMT2AMEN1L3MBTL1RAB9A
SCHEMBL1509146 0.81 EGLN1 (0.49) STAMBPKMT2AMEN1L3MBTL1GAA
SCHEMBL8784539 0.80 GAA (0.45) STAMBPKMT2AMEN1GAARAB9A
SCHEMBL966853 0.79 KMT2A (0.53) KMT2AMEN1L3MBTL1GAAMAPT
SCHEMBL8786558 0.79 SMPD1 (0.42) STAMBPKMT2AMEN1GAARAB9A
SCHEMBL1509716 0.77 EGLN1 (0.53) GAAMAPT
SCHEMBL8883714 0.77 MEN1 (0.50) KMT2AMEN1GAAMAPT
SCHEMBL8880594 0.77 MEN1 (0.50) KMT2AMEN1GAAMAPT

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-1893186-A2 IMPROVED TREATMENT FOR ANEMIA USING A HIF-ALPHA STABILISING AGENT FIBROGEN, INC. (US) 2008-03-05 EP disclosed
WO-2006133391-A2 IMPROVED TREATMENT FOR ANEMIA USING A HIF-ALPHA STABILISING AGENT FIBROGEN, INC. (US) 2006-12-14 WO disclosed