SCHEMBL7095887

SCHEMBL7095887

OCCc1ccc(OCc2ccc3ccccc3n2)cc1

nearest known ligand 0.79

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 12/20 0.79
FFAR1 O14842 1/20 0.72
AKR1B1 P15121 1/20 0.72
CYSLTR2 Q9NS75 9/20 0.68
GPBAR1 Q8TDU6 3/20 0.63
ALOX5 P09917 2/20 0.62
PDE10A Q9Y233 1/20 0.58

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
SCHEMBL8666314 0.89 CYSLTR1 (0.72) CYSLTR1FFAR1AKR1B1CYSLTR2GPBAR1
SCHEMBL3076102 0.88 CYSLTR1 (1.00) CYSLTR1FFAR1AKR1B1CYSLTR2GPBAR1
SCHEMBL10446560 0.86 CYSLTR1 (0.79) CYSLTR1FFAR1AKR1B1CYSLTR2GPBAR1
SCHEMBL10446852 0.86 CYSLTR1 (0.75) CYSLTR1FFAR1AKR1B1CYSLTR2GPBAR1
SCHEMBL8834916 0.85 FFAR1 (0.83) CYSLTR1FFAR1AKR1B1CYSLTR2GPBAR1
SCHEMBL8834305 0.85 CYSLTR1 (0.69) CYSLTR1FFAR1AKR1B1CYSLTR2GPBAR1
SCHEMBL8506505 0.85 CYSLTR1 (0.81) CYSLTR1CYSLTR2GPBAR1ALOX5
SCHEMBL8709593 0.84 FFAR1 (0.81) CYSLTR1FFAR1AKR1B1CYSLTR2GPBAR1
SCHEMBL8709596 0.84 FFAR1 (0.77) CYSLTR1FFAR1AKR1B1CYSLTR2GPBAR1
SCHEMBL10544473 0.84 CYSLTR1 (0.84) CYSLTR1FFAR1AKR1B1CYSLTR2GPBAR1

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 12 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
EP-0862557-A1 SYMMETRICAL bis-HETEROARYLMETHOXYPHENYLALKYL CARBOXYLATES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS Abbott Laboratories (US) 1998-09-09 EP disclosed
WO-1997034897-A1 FUSED IMIDAZOLE DERIVATIVES AS MULTIDRUG RESISTANCE MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 1997-09-25 WO disclosed
WO-1997012867-A1 SYMMETRICAL bis-HETEROARYLMETHOXYPHENYLALKYL CARBOXYLATES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS ABBOTT LABORATORIES (US) 1997-04-10 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 491/4885FFAR1 369/4885AKR1B1 116/4885

“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.