SCHEMBL2888112

SCHEMBL2888112

O=C(c1cc[c]cc1)c1ccncc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
LTA4H P09960 1/20 0.57
LMNA P02545 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
NPSR1 Q6W5P4 1/20 0.47
ALDH1A1 P00352 3/20 0.46
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 2/20 0.43
CYP2D6 P10635 2/20 0.43
CYP2C19 P33261 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MPO P05164 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
CYP2A6 P11509 1/20 0.43
GAA P10253 2/20 0.42
HSD17B10 Q99714 1/20 0.42
PLOD2 O00469 1/20 0.41
PLOD3 O60568 1/20 0.41

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
SCHEMBL725064 0.85 KMT2A (0.80) KMT2AMEN1LTA4HLMNAL3MBTL1
SCHEMBL1535886 0.85 ALDH1A1 (0.50) KMT2AMEN1LTA4HLMNAL3MBTL1
Hydrochloric Acid SCHEMBL28795867 0.83 KMT2A (0.76) KMT2AMEN1LTA4HLMNAL3MBTL1
SCHEMBL12551313 0.78 KMT2A (0.70) KMT2AMEN1LTA4HLMNAL3MBTL1
SCHEMBL3236383 0.78 ALDH1A1 (0.55) KMT2AMEN1LMNAALDH1A1CYP1A2
SCHEMBL27395626 0.78 KMT2A (0.62) KMT2AMEN1LTA4HLMNAL3MBTL1
SCHEMBL5237011 0.77 NAPRT (0.39) KMT2AMEN1LTA4HLMNAL3MBTL1
SCHEMBL144448 0.76 ALDH1A1 (0.70) KMT2AMEN1LMNAL3MBTL1NAPRT
SCHEMBL229650 0.76 KMT2A (1.00) KMT2AMEN1LTA4HLMNAL3MBTL1
SCHEMBL23113194 0.74 LMNA (0.71) KMT2AMEN1LMNAL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7776893-B2 Use of PDE4 inhibitors for the treatment of diabetes mellitus NYCOMED GMBH (DE) 2010-08-17 US disclosed
US-20060281745-A1 Use of pde4 inhibitors for the treatment of diabetes mellitus ALTANA PHARMA AG (DE) 2006-12-14 US disclosed
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
WO-2005023253-A1 USE OF PDE4 INHIBITORS FOR THE TREATMENT OF DIABETES MELLITUS ALTANA PHARMA AG (DE) 2005-03-17 WO disclosed
CN-1152864-C Phenylphenanthridines with PDE-IV inhibiting activity ��̹��ҽҩ��˾ 2004-06-09 CN disclosed
CN-1494906-A Application of compound in preparation of medicine for preventing and curing multiple drug resistance ��̩��˹ҩ��ɷ����޹�˾ 2004-05-12 CN disclosed
US-6476025-B1 Phenylphennanthridines with PDE-IV inhibiting activity ALTANA PHARMA AG (DE) 2002-11-05 US disclosed
CN-1086386-C Multi-drug resistance modifiers VERTEX PHARMA (US) 2002-06-19 CN disclosed
CN-1336919-A Phenylphenanthridines with PDE-IV inhibiting activity BYK GULDEN LOMBERG CHEM FAB (DE) 2002-02-20 CN 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060281745-A1 Use of pde4 inhibitors for the treatment of diabetes mellitus PDE4A, PDE4B, PDE12 KMT2A 3750/4885MEN1 3387/4885LTA4H 102/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.