SCHEMBL4255240

SCHEMBL4255240

CC(C)N1CCC(Cc2ccc(C(=O)O)o2)CC1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.51
KCNH2 Q12809 1/20 0.51
HTT P42858 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL4257514 0.86 ALDH1A1 (0.54) HRH3KCNH2HTTTDP1KDM4E
SCHEMBL4237305 0.79 HRH3 (0.61) HRH3KCNH2
SCHEMBL4255676 0.77 CCR3 (0.60) HTTKDM4E
SCHEMBL4249601 0.75 CCR3 (0.62) HRH3
SCHEMBL278451 0.71 HRH3 (0.71) HRH3KCNH2RAB9A
SCHEMBL4237287 0.71 MAOB (0.47) HRH3KCNH2
SCHEMBL14507935 0.70 HRH3 (0.54) HRH3KCNH2RAB9A
SCHEMBL14507943 0.69 ALDH1A1 (0.56) HRH3KCNH2
SCHEMBL14507936 0.69 HRH3 (0.52) HRH3KCNH2
SCHEMBL4240603 0.68 HRH3 (0.51) HRH3KCNH2

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 HRH3 61/4885KCNH2 394/4885HTT 725/4885

“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.