SCHEMBL5049112

SCHEMBL5049112

O=C(c1ccccc1)c1ccc(OCCCc2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.71
GAA P10253 1/20 0.68
PPARA Q07869 3/20 0.67
FFAR1 O14842 2/20 0.67
PLA2G4B P0C869 1/20 0.61
SRD5A2 P31213 1/20 0.59
LMNA P02545 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
MAPT P10636 1/20 0.57
S1PR1 P21453 1/20 0.57
S1PR3 Q99500 1/20 0.57
PPARD Q03181 1/20 0.57
NR1H4 Q96RI1 1/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
MAPK1 P28482 1/20 0.56
LTA4H P09960 1/20 0.56
HRH4 Q9H3N8 1/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56

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
SCHEMBL27613074 0.98 FFAR1 (0.69) PPARGGAAPPARAFFAR1PLA2G4B
SCHEMBL15981207 0.90 PPARA (0.68) PPARGGAAPPARAFFAR1PLA2G4B
SCHEMBL4361279 0.88 PLA2G4B (0.76) PPARGFFAR1PLA2G4BSRD5A2S1PR1
SCHEMBL11485988 0.88 PPARA (0.83) PPARGGAAPPARASRD5A2LMNA
SCHEMBL4561660 0.88 GAA (0.79) PPARGGAAPPARASRD5A2LMNA
SCHEMBL14689477 0.86 PPARA (0.81) GAAPPARALMNAL3MBTL1MAPT
SCHEMBL6652325 0.86 PPARA (0.81) GAAPPARALMNAL3MBTL1MAPT
SCHEMBL20624042 0.86 PPARA (0.81) GAAPPARALMNAL3MBTL1MAPT
SCHEMBL2127341 0.86 PPARA (0.81) GAAPPARALMNAL3MBTL1MAPT
SCHEMBL2127003 0.86 PPARA (0.81) GAAPPARALMNAL3MBTL1MAPT

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-7361668-B2 Quinuclidine derivatives processes for preparing them and their uses as m2 and/or m3 muscarinic receptor inhibitors UCB, S.A. (BE) 2008-04-22 US disclosed
US-20050020660-A1 Quinuclidine derivatives processes for preparing them and their uses as m2 and/or m3 muscarinic receptor inhibitors UCB, S.A. (BE) 2005-01-27 US disclosed
EP-1438309-A1 QUINUCLIDINE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES AS M2 AND/OR M3 MUSCARINIC RECEPTOR INHIBITORS UCB, S.A. (BE) 2004-07-21 EP disclosed
WO-2003033495-A1 QUINUCLIDINE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES AS M2 AND/OR M3 MUSCARINIC RECEPTOR INHIBITORS UCB, S.A. (BE) 2003-04-24 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-20050020660-A1 Quinuclidine derivatives processes for preparing them and their uses as m2 and/or m3 muscarinic receptor inhibitors CHRM2, CHRM3, CHRM1 PPARG 521/4885GAA 1777/4885PPARA 1226/4885

“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.