SCHEMBL4960060

SCHEMBL4960060

CCOC(=O)c1nc(CC)sc1NC(=O)c1ccc(Oc2ccccc2)nc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSA P10619 2/20 0.47
GRN P28799 2/20 0.47
SORT1 Q99523 2/20 0.47
MCHR1 Q99705 1/20 0.44
OPRM1 P35372 3/20 0.42
OPRD1 P41143 3/20 0.42
OPRK1 P41145 1/20 0.42
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41
GAA P10253 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LIPE Q05469 1/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 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
SCHEMBL1968361 0.78 ALDH1A1 (0.47) CYP1A2CYP2C9CYP2C19POLBALDH1A1
SCHEMBL2255952 0.77 PDE4B (0.56) CTSAGRNSORT1OPRM1OPRD1
SCHEMBL4955898 0.74 ALDH1A1 (0.61) CYP2C9CYP2C19POLBALDH1A1HPGD
SCHEMBL13224737 0.73 SMN1; SMN2 (0.56) CYP1A2CYP2C9CYP2C19L3MBTL1ALDH1A1
SCHEMBL7637674 0.71 NPC1 (0.63) CTSAGRNSORT1MCHR1ALDH1A1
SCHEMBL23149723 0.70 GRN (0.51) CTSAGRNSORT1OPRM1OPRD1
SCHEMBL4959888 0.70 ALDH1A1 (0.56) POLBALDH1A1HPGDGAANPC1
SCHEMBL1968562 0.70 MAPK1 (0.52) CYP1A2POLBALDH1A1HPGDGAA
SCHEMBL1969591 0.70 ALDH1A1 (0.46) POLBALDH1A1HPGDMEN1KMT2A
SCHEMBL6120802 0.69 OPRM1 (0.67) CTSAGRNSORT1OPRM1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312291-A1 Heterocyclic Gaba-b Modulators ASTRAZENECA AB (SE) 2008-12-18 US claimed
EP-1966176-A1 HETEROCYCLIC GABA-B MODULATORS AstraZeneca AB (SE) 2008-09-10 EP claimed
WO-2007073296-A1 HETEROCYCLIC GABA-B MODULATORS ASTRAZENECA AB (SE) 2007-06-28 WO claimed
US-20080312291-A1 Heterocyclic Gaba-b Modulators ASTRAZENECA AB (SE) 2008-12-18 US disclosed
US-20080312291-A1 Heterocyclic Gaba-b Modulators ASTRAZENECA AB (SE) 2008-12-18 US disclosed
US-20080312291-A1 Heterocyclic Gaba-b Modulators ASTRAZENECA AB (SE) 2008-12-18 US disclosed
EP-1966176-A1 HETEROCYCLIC GABA-B MODULATORS AstraZeneca AB (SE) 2008-09-10 EP disclosed
WO-2007073296-A1 HETEROCYCLIC GABA-B MODULATORS ASTRAZENECA AB (SE) 2007-06-28 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-20080312291-A1 Heterocyclic Gaba-b Modulators GABBR1, GABBR2, GABRB1 CTSA 3124/4885GRN 2588/4885SORT1 4821/4885

“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.