SCHEMBL5567648

SCHEMBL5567648

COc1ccc(C2CCCCC2NC(=O)c2cc(OC)c(OC)c(OC)c2)cc1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.51
MAPK1 P28482 1/20 0.50
OPRK1 P41145 1/20 0.50
TDP1 Q9NUW8 1/20 0.49
TAS1R3 Q7RTX0 2/20 0.48
TAS1R1 Q7RTX1 2/20 0.48
KDM1A O60341 2/20 0.47
SIRT5 Q9NXA8 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALPL P05186 1/20 0.46
PKM P14618 1/20 0.46
CXCR6 O00574 1/20 0.45
CXCR4 P61073 1/20 0.45
BRD4 O60885 1/20 0.45
TSHR P16473 1/20 0.44
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44

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
SCHEMBL5567651 1.00 POLB (0.51) POLBMAPK1OPRK1TDP1TAS1R3
SCHEMBL7237706 0.90 TAS1R3 (0.42) POLBMAPK1OPRK1TDP1TAS1R3
SCHEMBL7237703 0.90 TAS1R3 (0.42) POLBMAPK1OPRK1TDP1TAS1R3
SCHEMBL7415429 0.87 ALDH1A1 (0.47) MAPK1TAS1R3TAS1R1KDM1AMEN1
SCHEMBL7415428 0.87 ALDH1A1 (0.47) MAPK1TAS1R3TAS1R1KDM1AMEN1
SCHEMBL7204083 0.86 TAS1R3 (0.51) TAS1R3TAS1R1KDM1AMEN1KMT2A
SCHEMBL5737318 0.86 TAS1R3 (0.51) TAS1R3TAS1R1KDM1AMEN1KMT2A
SCHEMBL5053376 0.86 TAS1R3 (0.51) TAS1R3TAS1R1KDM1AMEN1KMT2A
SCHEMBL5734935 0.85 PDE4D (0.58)
SCHEMBL7402512 0.85 MCHR1 (0.52) TAS1R3TAS1R1KDM1AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1163226-B1 POLYSUBSTITUTED 6-PHENYLPHENANTHRIDINES WITH PDE-IV INHIBITING ACTIVITY ALTANA PHARMA AG (DE) 2007-03-14 EP disclosed
US-6534518-B1 Phosphodiesterase inhibitors for respiratory system disorders ALTANA PHARMA AG (DE) 2003-03-18 US disclosed
EP-1163226-A1 POLYSUBSTITUTED 6-PHENYLPHENANTHRIDINES WITH PDE-IV INHIBITING ACTIVITY Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2001-12-19 EP disclosed
WO-2000042018-A1 POLYSUBSTITUTED 6-PHENYLPHENANTHRIDINES WITH PDE-IV INHIBITING ACTIVITY BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-07-20 WO disclosed