SCHEMBL7204083

SCHEMBL7204083

COC(=O)c1ccc(C(=O)NC2CCCCC2c2ccc(OC)c(OC)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 3/20 0.51
TAS1R1 Q7RTX1 3/20 0.51
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
ALPL P05186 1/20 0.48
PDE4A P27815 2/20 0.48
PDE4B Q07343 2/20 0.48
PDE4C Q08493 2/20 0.48
PDE4D Q08499 2/20 0.48
MAPT P10636 2/20 0.45
KDM1A O60341 2/20 0.45
SPTLC2 O15270 5/20 0.43
PDE5A O76074 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL5053376 1.00 TAS1R3 (0.51) TAS1R3TAS1R1MEN1KMT2AALPL
SCHEMBL5737318 0.91 TAS1R3 (0.51) TAS1R3TAS1R1MEN1KMT2AALPL
SCHEMBL5063703 0.90 TAS1R3 (0.48) TAS1R3TAS1R1MEN1KMT2AALPL
SCHEMBL7402512 0.90 MCHR1 (0.52) TAS1R3TAS1R1MEN1KMT2AALPL
SCHEMBL7402511 0.90 MCHR1 (0.52) TAS1R3TAS1R1MEN1KMT2AALPL
SCHEMBL5733789 0.88 ALDH1A1 (0.52) TAS1R3TAS1R1MEN1KMT2AALPL
SCHEMBL5733889 0.88 TACR1 (0.51) TAS1R3TAS1R1MEN1KMT2APDE4A
SCHEMBL5733787 0.88 ALDH1A1 (0.52) TAS1R3TAS1R1MEN1KMT2AALPL
SCHEMBL5734634 0.88 TAS1R3 (0.48) TAS1R3TAS1R1MEN1KMT2AALPL
SCHEMBL5734639 0.88 TAS1R3 (0.48) TAS1R3TAS1R1MEN1KMT2AALPL

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-0882021-B1 NEW PHENANTHRIDINES ALTANA PHARMA AG (DE) 2003-03-05 EP disclosed
WO-2002006239-A1 PHENANTHRIDINE N-OXIDES ALTANA PHARMA AG (DE) 2002-01-24 WO disclosed
US-6191138-B1 THERAPY FOR RESPIRATORY SYSTEM DISORDERS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2001-02-20 US disclosed