SCHEMBL4249601

SCHEMBL4249601

O=C(O)c1ccc(CC2CCN(CCc3ccccc3)CC2)o1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.62
HTR2A P28223 1/20 0.52
SIGMAR1 Q99720 2/20 0.51
HDAC1 Q13547 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
HTR1A P08908 1/20 0.49
SLC6A4 P31645 1/20 0.49
HRH3 Q9Y5N1 1/20 0.49

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
SCHEMBL4256865 0.87 CCR3 (0.55) CCR3HTR1ASLC6A4
SCHEMBL4255676 0.87 CCR3 (0.60) CCR3HDAC1HDAC8HDAC6
SCHEMBL7403790 0.78 CCR3 (1.00) CCR3SIGMAR1HTR1ASLC6A4HRH3
Hydrochloric Acid SCHEMBL7404097 0.76 CCR3 (0.97) CCR3SIGMAR1HTR1ASLC6A4HRH3
SCHEMBL7407241 0.76 CCR3 (0.82) CCR3SIGMAR1
SCHEMBL4255240 0.75 HRH3 (0.51) HRH3
SCHEMBL23123778 0.75 CCR3 (0.61) CCR3HTR2ASIGMAR1HDAC1HDAC8
Hydrochloric Acid SCHEMBL7410288 0.75 CCR3 (0.80) CCR3SIGMAR1
SCHEMBL4259804 0.75 ALDH1A1 (0.61) CCR3
SCHEMBL1918964 0.73 CCR3 (0.73) CCR3HTR2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090239860-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-09-24 US disclosed
EP-1710233-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE Kissei Pharmaceutical Co., Ltd. (JP) 2006-10-11 EP 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-20090239860-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE ADORA2A, ADORA2B, HTR1F CCR3 2934/4885HTR2A 6/4885SIGMAR1 130/4885

“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.