SCHEMBL21982991

SCHEMBL21982991

CCN(CCO)CCC[C@@H](C)Nc1c(Cl)cnc2cc(Cl)ccc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.71
CHRM2 P08172 3/20 0.71
CHRM4 P08173 3/20 0.71
CHRM5 P08912 3/20 0.71
ADRA2A P08913 3/20 0.71
CHRM1 P11229 3/20 0.71
ADRA2B P18089 3/20 0.71
ADRA2C P18825 3/20 0.71
CHRM3 P20309 3/20 0.71
KCNH2 Q12809 3/20 0.71
TMEM97 Q5BJF2 2/20 0.71
SIGMAR1 Q99720 2/20 0.71
ACE2 Q9BYF1 2/20 0.71
ADRA1D P25100 2/20 0.71
CGAS Q8N884 2/20 0.71
TLR9 Q9NR96 1/20 0.71
TLR7 Q9NYK1 1/20 0.71
CYP2D6 P10635 3/20 0.59
PRNP P04156 2/20 0.59
MTOR P42345 2/20 0.59

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
SCHEMBL18292453 1.00 LMNA (0.71) LMNACHRM2CHRM4CHRM5ADRA2A
SCHEMBL18292600 1.00 LMNA (0.71) LMNACHRM2CHRM4CHRM5ADRA2A
SCHEMBL21983282 0.90 LMNA (0.68) LMNACHRM2CHRM4CHRM5ADRA2A
SCHEMBL18292456 0.88 LMNA (0.65) LMNACHRM2CHRM4CHRM5ADRA2A
SCHEMBL18292454 0.88 LMNA (0.65) LMNACHRM2CHRM4CHRM5ADRA2A
SCHEMBL18292519 0.87 LMNA (0.64) LMNACHRM2CHRM4CHRM5ADRA2A
SCHEMBL18292455 0.85 LMNA (0.61) LMNACHRM2CHRM4CHRM5ADRA2A
SCHEMBL21982994 0.85 LMNA (0.61) LMNACHRM2CHRM4CHRM5ADRA2A
SCHEMBL18292457 0.84 LMNA (0.60) LMNACHRM2CHRM4CHRM5ADRA2A
SCHEMBL1612342 0.83 CYP2D6 (0.67) LMNACHRM2CHRM4CHRM5ADRA2A

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-10647677-B2 Analogues of hydroxychloroquine (HCQ) without retinal toxicity INOVIEM SCIENTIFIC (FR) 2020-05-12 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-10647677-B2 Analogues of hydroxychloroquine (HCQ) without retinal toxicity SSB, UACA, XPA LMNA 133/4885CHRM2 3788/4885CHRM4 3871/4885

“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.