SCHEMBL5568509

SCHEMBL5568509

COc1ccc(C2CCCCC2NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 5/20 0.48
TAS1R1 Q7RTX1 5/20 0.48
TAS1R2 Q8TE23 2/20 0.48
HCRTR1 O43613 6/20 0.42
KDM1A O60341 2/20 0.42
HCRTR2 O43614 3/20 0.41
CCR2 P41597 1/20 0.41
KMT2A Q03164 2/20 0.40
PDE4B Q07343 2/20 0.40
MEN1 O00255 1/20 0.40
ALPL P05186 1/20 0.40

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
SCHEMBL5568502 1.00 TAS1R3 (0.48) TAS1R3TAS1R1TAS1R2HCRTR1KDM1A
SCHEMBL5567648 0.84 POLB (0.51) TAS1R3TAS1R1KDM1AKMT2AMEN1
SCHEMBL5567651 0.84 POLB (0.51) TAS1R3TAS1R1KDM1AKMT2AMEN1
SCHEMBL7402512 0.84 MCHR1 (0.52) TAS1R3TAS1R1KDM1AKMT2APDE4B
SCHEMBL7402511 0.84 MCHR1 (0.52) TAS1R3TAS1R1KDM1AKMT2APDE4B
SCHEMBL5053376 0.82 TAS1R3 (0.51) TAS1R3TAS1R1KDM1AKMT2APDE4B
SCHEMBL5737318 0.82 TAS1R3 (0.51) TAS1R3TAS1R1KDM1AKMT2APDE4B
SCHEMBL7204083 0.82 TAS1R3 (0.51) TAS1R3TAS1R1KDM1AKMT2APDE4B
SCHEMBL5046814 0.81 KMT2A (0.52) TAS1R3TAS1R1KDM1ACCR2KMT2A
SCHEMBL5046817 0.81 KMT2A (0.52) TAS1R3TAS1R1KDM1ACCR2KMT2A

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