SCHEMBL7092609

SCHEMBL7092609

OCCOc1cccc(OCc2ccc3ccccc3n2)c1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 13/20 0.76
GPBAR1 Q8TDU6 7/20 0.76
CYSLTR2 Q9NS75 7/20 0.74
PDE10A Q9Y233 1/20 0.60

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
SCHEMBL6088376 0.84 CYSLTR1 (0.72) CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL8506505 0.84 CYSLTR1 (0.81) CYSLTR1GPBAR1CYSLTR2
SCHEMBL4848317 0.83 CYSLTR1 (1.00) CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL30443879 0.83 CYSLTR1 (1.00) CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL14021495 0.83 CYSLTR1 (1.00) CYSLTR1GPBAR1CYSLTR2
SCHEMBL27485722 0.83 CYSLTR1 (0.75) CYSLTR1GPBAR1CYSLTR2PDE10A
Hydrogen Sulfide SCHEMBL9818428 0.83 CYSLTR1 (0.71) CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL25214523 0.82 GPBAR1 (0.75) CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL10548756 0.82 CYSLTR1 (0.71) CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL14021598 0.82 CYSLTR1 (0.71) CYSLTR1GPBAR1CYSLTR2PDE10A

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
EP-0888352-B1 FUSED IMIDAZOLE DERIVATIVES AS MULTIDRUG RESISTANCE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2003-05-28 EP disclosed
US-20030087895-A1 Fused imidazole derivatives as multidrug resistance modulators JANSSENS FRANS EDUARD (BE) 2003-05-08 US disclosed
US-6544979-B1 Having multidrug resistance modulating properties JANSSEN PHARMACEUTICALS, N.V. (BE) 2003-04-08 US disclosed
EP-1011726-B1 FUSED IMIDAZOLE DERIVATIVES FOR IMPROVING ORAL BIOAVAILABILITY OF PHARMACEUTICAL AGENTS JANSSEN PHARMACEUTICA NV (BE) 2003-02-26 EP disclosed
US-6476018-B1 Fused imidazole derivatives as multidrug resistance modulators JANSSEN PHARMACEUTICA N.V. (BE) 2002-11-05 US disclosed
US-6218381-B1 FOR DECREASING, ELIMINATING OR REVERSING A DEVELOPING OR EXISTING RESISTANCE TO CHEMOTHERAPEUTIC DRUG THERAPY JANSSEN PHARMACEUTICA N.V. (BE) 2001-04-17 US disclosed
EP-1011726-A2 FUSED IMIDAZOLE DERIVATIVES FOR IMPROVING ORAL BIOAVAILABILITY OF PHARMACEUTICAL AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 2000-06-28 EP disclosed
WO-1999013871-A2 FUSED IMIDAZOLE DERIVATIVES FOR IMPROVING ORAL BIOAVAILABILITY OF PHARMACEUTICAL AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 1999-03-25 WO disclosed
EP-0888352-A1 FUSED IMIDAZOLE DERIVATIVES AS MULTIDRUG RESISTANCE MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 1999-01-07 EP disclosed
WO-1997034897-A1 FUSED IMIDAZOLE DERIVATIVES AS MULTIDRUG RESISTANCE MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 1997-09-25 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-20030087895-A1 Fused imidazole derivatives as multidrug resistance modulators ABCC1, CBR1, ABCB11 CYSLTR1 491/4885GPBAR1 60/4885CYSLTR2 807/4885

“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.