SCHEMBL6748209

SCHEMBL6748209

Clc1cncc(OCCCCCCBr)c1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 8/20 0.57
CHRNA4 P43681 8/20 0.57
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40

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
SCHEMBL2431234 0.87 CHRNB2 (0.62) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL3050102 0.83 CHRNB2 (0.70) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL7237076 0.82 CHRNB2 (0.64) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL6602521 0.81 CHRNB2 (0.63) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL4055639 0.80 MAPT (0.50)
SCHEMBL7098510 0.79 CHRNB2 (0.60) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL4940273 0.79 CHRNB2 (0.43) CHRNB2CHRNA4
SCHEMBL5658557 0.79 CHRNB2 (0.65) CHRNB2CHRNA4
SCHEMBL4930731 0.77 CHRNB2 (0.67) CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL4311522 0.77 CHRNB2 (0.62) CHRNB2CHRNA4CHRNB4CHRNA3

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-6706739-B2 TREATING ENTEROVIRUS INFECTION NATIONAL HEALTH RESEARCH INSTITUTE (TW) 2004-03-16 US disclosed
US-20030087936-A1 Imidazolidinone compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2003-05-08 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-20030087936-A1 Imidazolidinone compounds EIF2AK2, ZC3HAV1, EMG1 CHRNB2 4688/4885CHRNA4 4585/4885CHRNB4 4707/4885

“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.