SCHEMBL2885830

SCHEMBL2885830

CN(C)S(=O)(=O)Oc1c[c]ccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.42
ALDH1A1 P00352 8/20 0.38
MEN1 O00255 8/20 0.38
KMT2A Q03164 8/20 0.38
SMN1; SMN2 Q16637 8/20 0.38
HTT P42858 6/20 0.38
NPC1 O15118 5/20 0.38
MAPT P10636 4/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
NFKB1 P19838 1/20 0.38
STAT3 P40763 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
GAA P10253 2/20 0.37
LMNA P02545 5/20 0.36
CYP3A4 P08684 1/20 0.36
CASP3 P42574 1/20 0.36

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
SCHEMBL2287643 0.79 ALDH1A1 (0.35) ALDH1A1GAALMNACA2CA12
SCHEMBL2887346 0.77 RAB9A (0.51) RAB9AALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL1538262 0.77 RAB9A (0.55) RAB9AALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL21798 0.76 KMT2A (0.39) KMT2AHTTLMNACA2CA12
SCHEMBL1404374 0.76 CISD1 (0.35) MEN1KMT2AGAACA2
SCHEMBL2767385 0.76 CA2 (0.57) CA2
SCHEMBL27291761 0.75 RAB9A (0.53) RAB9AALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL4417910 0.73 CA1 (0.35) KMT2ACA2
SCHEMBL4600112 0.71 TDP1 (0.51) RAB9AALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL2886091 0.71 MEN1 (0.44) ALDH1A1MEN1KMT2ASMN1; SMN2HTT

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 7 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
WO-2005023253-A1 USE OF PDE4 INHIBITORS FOR THE TREATMENT OF DIABETES MELLITUS ALTANA PHARMA AG (DE) 2005-03-17 WO 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

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 RAB9A 2699/4885ALDH1A1 1341/4885MEN1 3387/4885

“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.