SCHEMBL5735720

SCHEMBL5735720

COc1ccc([C@H]2CCCC[C@H]2NC(=O)c2ccc(CCl)cc2)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 3/20 0.50
TAS1R1 Q7RTX1 3/20 0.50
SSTR3 P32745 2/20 0.48
PDE4A P27815 3/20 0.45
PDE4B Q07343 3/20 0.45
PDE4C Q08493 3/20 0.45
PDE4D Q08499 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
SPTLC2 O15270 5/20 0.43
MCHR1 Q99705 1/20 0.43
ALPL P05186 1/20 0.43
EPHX1 P07099 1/20 0.42
KDM1A O60341 1/20 0.42
PPARG P37231 1/20 0.42
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42

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
SCHEMBL5735715 1.00 TAS1R3 (0.50) TAS1R3TAS1R1SSTR3PDE4APDE4B
SCHEMBL5735847 0.93 TAS1R3 (0.48) TAS1R3TAS1R1SSTR3PDE4APDE4B
SCHEMBL5735842 0.93 TAS1R3 (0.48) TAS1R3TAS1R1SSTR3PDE4APDE4B
SCHEMBL5733275 0.88 TAS1R3 (0.47) TAS1R3TAS1R1SSTR3PDE4APDE4B
SCHEMBL5733272 0.88 TAS1R3 (0.47) TAS1R3TAS1R1SSTR3PDE4APDE4B
SCHEMBL7204083 0.87 TAS1R3 (0.51) TAS1R3TAS1R1PDE4APDE4BPDE4C
SCHEMBL5737318 0.87 TAS1R3 (0.51) TAS1R3TAS1R1PDE4APDE4BPDE4C
SCHEMBL5053376 0.87 TAS1R3 (0.51) TAS1R3TAS1R1PDE4APDE4BPDE4C
SCHEMBL5734634 0.86 TAS1R3 (0.48) TAS1R3TAS1R1SSTR3PDE4BMEN1
SCHEMBL5734639 0.86 TAS1R3 (0.48) TAS1R3TAS1R1SSTR3PDE4BMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1650193-A2 6-Phenylphenanthridines with PDE-IV inhibiting activity ALTANA Pharma AG (DE) 2006-04-26 EP disclosed
EP-1147089-B1 PHENYLPHENANTHRIDINES WITH PDE-IV INHIBITING ACTIVITY ALTANA PHARMA AG (DE) 2005-12-07 EP disclosed
US-6476025-B1 Phenylphennanthridines with PDE-IV inhibiting activity ALTANA PHARMA AG (DE) 2002-11-05 US disclosed
EP-1147089-A1 PHENYLPHENANTHRIDINES WITH PDE-IV INHIBITING ACTIVITY Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2001-10-24 EP disclosed
WO-2000042020-A1 PHENYLPHENANTHRIDINES WITH PDE-IV INHIBITING ACTIVITY BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-07-20 WO disclosed