SCHEMBL5734459

SCHEMBL5734459

COc1ccc(C2CCCCC2NC(=O)c2cccc(OCc3ccccc3)c2)cc1OC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.49
NR4A2 P43354 1/20 0.47
APP P05067 2/20 0.47
NR1H4 Q96RI1 1/20 0.47
FAAH O00519 1/20 0.46
CNR2 P34972 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
MAOB P27338 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
GUSB P08236 1/20 0.46
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HPGD P15428 1/20 0.45
PDE4B Q07343 1/20 0.45
CSF1R P07333 1/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 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
SCHEMBL5734464 1.00 SMPD1 (0.49) SMPD1NR4A2APPNR1H4FAAH
SCHEMBL5743680 0.91 RAB9A (0.44) NR1H4RAB9ASMN1; SMN2HPGDPDE4B
SCHEMBL5743683 0.91 RAB9A (0.44) NR1H4RAB9ASMN1; SMN2HPGDPDE4B
SCHEMBL5736521 0.90 SMPD1 (0.59) SMPD1APPHDAC1HDAC8HDAC6
SCHEMBL5733718 0.88 PKM (0.57) HDAC8MEN1KMT2APDE4BNPC1
SCHEMBL5733720 0.88 PKM (0.57) HDAC8MEN1KMT2APDE4BNPC1
SCHEMBL5733187 0.87 NR1H4 (0.49) NR1H4RAB9ASMN1; SMN2HPGDPDE4B
SCHEMBL5733193 0.87 NR1H4 (0.49) NR1H4RAB9ASMN1; SMN2HPGDPDE4B
SCHEMBL5733652 0.84 PDE4A (0.53) SMPD1APPHDAC1HDAC8HDAC6
SCHEMBL5734789 0.84 TACR1 (0.49) MEN1KMT2AHPGDPDE4BALDH1A1

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