SCHEMBL10025501

SCHEMBL10025501

COCCCN1CCC(N2CCCC2)CC1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.55
CYP3A4 P08684 2/20 0.47
CYP2C9 P11712 2/20 0.47
MAOA P21397 2/20 0.43
MAOB P27338 2/20 0.43
L3MBTL3 Q96JM7 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL18232042 0.89 HRH3 (0.55) HRH3CYP3A4CYP2C9L3MBTL3L3MBTL1
SCHEMBL24802112 0.84 HRH3 (0.45) HRH3CYP3A4CYP2C9
SCHEMBL13541805 0.81 HRH3 (0.51) HRH3CYP3A4CYP2C9MAOAMAOB
SCHEMBL25955489 0.81 HRH3 (0.39) HRH3CYP3A4CYP2C9
SCHEMBL1277016 0.80 HRH3 (0.52) HRH3L3MBTL1
SCHEMBL13541802 0.80 HRH3 (0.53) HRH3CYP3A4CYP2C9MAOAMAOB
SCHEMBL10025499 0.80 HRH3 (0.60) HRH3CYP3A4CYP2C9MAOAMAOB
SCHEMBL2331849 0.78 HRH3 (0.56) HRH3L3MBTL1
SCHEMBL96486 0.78 HRH3 (0.56) HRH3L3MBTL1
SCHEMBL24326956 0.78 HRH3 (0.50) HRH3L3MBTL3L3MBTL1

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-8207173-B2 Benzimidazoles and analogs thereof as antivirals ISIS PHARMACEUTICALS, INC. (US) 2012-06-26 US disclosed
US-8207173-B2 Benzimidazoles and analogs thereof as antivirals ISIS PHARMACEUTICALS, INC. (US) 2012-06-26 US disclosed
US-20100130513-A1 BENZIMIDAZOLES AND ANALOGS THEREOF AS ANTIVIRALS ISIS PHARMACEUTICALS, INC. (US) 2010-05-27 US disclosed
US-20100130513-A1 BENZIMIDAZOLES AND ANALOGS THEREOF AS ANTIVIRALS ISIS PHARMACEUTICALS, INC. (US) 2010-05-27 US 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-20100130513-A1 BENZIMIDAZOLES AND ANALOGS THEREOF AS ANTIVIRALS ZC3HAV1, NXF1, ZC3HAV1L HRH3 1057/4885CYP3A4 320/4885CYP2C9 1513/4885

“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.