SCHEMBL6715048

SCHEMBL6715048

O=S(=O)(Nc1ccc(C2=NCCc3ccc(Oc4ccccc4)cc32)cc1)c1sccc1S(=O)(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PGR P06401 17/20 0.41
NR3C1 P04150 1/20 0.39
AR P10275 1/20 0.39
ESR2 Q92731 1/20 0.39
SCN9A Q15858 1/20 0.36
ATM Q13315 1/20 0.36
FFAR1 O14842 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
SCHEMBL6718767 0.87 MAPT (0.36) PGRATM
SCHEMBL6718889 0.86 NPSR1 (0.37) PGR
SCHEMBL6715044 0.84 PGR (0.42) PGRNR3C1ARESR2FFAR1
SCHEMBL6714937 0.81 PGR (0.38) PGR
SCHEMBL6776203 0.81 FFAR1 (0.60) PGRARFFAR1
SCHEMBL6724676 0.81 PGR (0.62) PGRATMFFAR1
SCHEMBL6718280 0.80 PGR (0.66) PGRNR3C1ARESR2
SCHEMBL6718603 0.80 LMNA (0.36)
SCHEMBL7174912 0.80 THRB (0.40) PGRNR3C1ARESR2
SCHEMBL6718287 0.78 FFAR1 (0.47) PGRNR3C1ARESR2FFAR1

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
US-6818651-B2 ANTIINFLAMMATORY, ANTIASTHMATIC, SKIN, AND AUTOIMMUNE DISORDERS; CROHN*S DISEASE, ULCERATIVE COLITIS, CONJUCTIVITIS, MULTIPLE SCLEROSIS, AND RHEUMATOID ARTHRITIS; CHRONIC OBSTRUCTIVE PULMONARY DISEASE ALTANA PHARMA AG (DE) 2004-11-16 US disclosed
US-20040044212-A1 (Dihydro) Isoquinoline derivatives as phosphodiesterase inhibitors ALTANA PHARMA AG (DE) 2004-03-04 US disclosed
EP-1337515-A1 (DIHYDRO)ISOQUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2003-08-27 EP disclosed
WO-2002040450-A1 (DIHYDRO)ISOQUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS ALTANA PHARMA AG (DE) 2002-05-23 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-20040044212-A1 (Dihydro) Isoquinoline derivatives as phosphodiesterase inhibitors PDE7B, PDE3B, PDE3A PGR 3452/4885NR3C1 2751/4885AR 108/4885

“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.