SCHEMBL8198682

SCHEMBL8198682

NCc1cc(F)c(F)c2c1NC(=O)CO2

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 4/20 0.34
ADRB1 P08588 10/20 0.34
ADRB2 P07550 4/20 0.34
DRD2 P14416 3/20 0.32
DRD4 P21917 3/20 0.32
DRD3 P35462 3/20 0.32
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
NR3C1 P04150 1/20 0.31
PGR P06401 1/20 0.31
PARP1 P09874 1/20 0.30

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
SCHEMBL8190736 0.87 PARP1 (0.39) NR3C2ADRB1ADRB2DRD2DRD4
SCHEMBL8191321 0.77 MMP12 (0.37) NR3C2ADRB1ADRB2DRD2DRD4
SCHEMBL8189599 0.77 NR3C2 (0.34) NR3C2ADRB1ADRB2DRD2DRD4
SCHEMBL8191264 0.77 DRD2 (0.33) NR3C2ADRB1ADRB2DRD2DRD4
SCHEMBL8201338 0.75 NR3C2 (0.37) NR3C2ADRB1ADRB2ALDH1A1NR3C1
SCHEMBL14079848 0.75 NR3C2 (0.34) NR3C2ADRB1ADRB2DRD2DRD4
SCHEMBL8182100 0.73 NR3C2 (0.34) NR3C2DRD2DRD4DRD3NR3C1
SCHEMBL8201875 0.73 NR3C2 (0.39) NR3C2ADRB1ADRB2DRD2DRD4
SCHEMBL30957066 0.73 DRD2 (0.33) NR3C2ADRB1ADRB2DRD2DRD4
SCHEMBL8189655 0.72 L3MBTL1 (0.38) ADRB1ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7713966-B2 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2010-05-11 US disclosed
US-7713966-B2 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2010-05-11 US disclosed
US-20080261968-A1 Heterobicyclic metalloprotease inhibitors GEGE CHRISTIAN 2008-10-23 US disclosed
US-20080261968-A1 Heterobicyclic metalloprotease inhibitors GEGE CHRISTIAN 2008-10-23 US disclosed
WO-2008109181-A2 METALLOPROTEASE INHIBITORS CONTAINING A HETEROCYCLIC MOIETY ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2008-09-12 WO disclosed
WO-2008109180-A2 METALLOPROTEASE INHIBITORS CONTAINING A HETEROCYCLIC MOIETY ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2008-09-12 WO disclosed
US-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-09-11 US disclosed
US-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-09-11 US disclosed
US-20080221095-A1 Metalloprotease inhibitors containing a heterocyclic moiety ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-09-11 US disclosed
US-20080221095-A1 Metalloprotease inhibitors containing a heterocyclic moiety ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-09-11 US 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 (3 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-20080221093-A1 Metalloprotease inhibitors containing a heterocyclic moiety MMP12, MMP13, MMP25 NR3C2 2939/4885ADRB1 4627/4885ADRB2 4783/4885
US-20080221095-A1 Metalloprotease inhibitors containing a heterocyclic moiety MMP13, MMP11, MMP3 NR3C2 4340/4885ADRB1 4841/4885ADRB2 4810/4885
US-20080261968-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 NR3C2 2202/4885ADRB1 4671/4885ADRB2 4584/4885

“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.