SCHEMBL6480822

SCHEMBL6480822

CCCCCN1CCN(c2ccccc2C2CCC3(CC2)CC3)CC1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.59
LMNA P02545 1/20 0.59
HTR1A P08908 4/20 0.53
ADRA1B P35368 2/20 0.52
DRD2 P14416 5/20 0.49
DRD3 P35462 5/20 0.49
DRD4 P21917 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 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
Hydrochloric Acid SCHEMBL4859939 0.99 KDM4E (0.57) KDM4ELMNAHTR1AADRA1BDRD2
Hydrochloric Acid SCHEMBL4852892 0.95 KDM4E (0.52) KDM4ELMNAHTR1AADRA1BDRD2
Hydrochloric Acid SCHEMBL4849870 0.94 HTR1A (0.57) KDM4ELMNAHTR1AADRA1BDRD2
SCHEMBL4250223 0.92 HTR1A (0.59) KDM4ELMNAHTR1AADRA1BDRD2
Hydrochloric Acid SCHEMBL4856005 0.91 HTR1A (0.58) KDM4ELMNAHTR1AADRA1BDRD2
Hydrochloric Acid SCHEMBL4857814 0.90 HTR1A (0.54) KDM4ELMNAHTR1AADRA1BDRD2
Hydrochloric Acid SCHEMBL4852289 0.90 HTR1A (0.57) KDM4ELMNAHTR1AADRA1BDRD2
Hydrochloric Acid SCHEMBL4858384 0.89 KDM4E (0.57) KDM4ELMNAHTR1AADRA1BDRD2
Hydrochloric Acid SCHEMBL4852985 0.88 KDM4E (0.56) KDM4ELMNAHTR1AADRA1BDRD2
SCHEMBL14064640 0.86 KDM4E (0.53) KDM4ELMNAHTR1AADRA1BDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050261291-A1 1,2-Di(cyclic)substituted benzene compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-11-24 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-20050261291-A1 1,2-Di(cyclic)substituted benzene compounds CCR10, HRH3, HRH2 KDM4E 3582/4885LMNA 4842/4885HTR1A 1013/4885

“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.