SCHEMBL22472944

SCHEMBL22472944

CCOC(=O)N1C(C)CC(N2CCC(C(=O)NC3(C)CCC3)CC2)CC1C

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 11/20 0.67
ALDH1A1 P00352 3/20 0.34
GAA P10253 2/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM5 P08912 1/20 0.33

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
SCHEMBL15618571 0.90 CHRM1 (0.68) CHRM1CHRM2CHRM5
SCHEMBL22472937 0.90 CHRM1 (0.55) CHRM1
SCHEMBL15618702 0.89 CHRM1 (0.70) CHRM1CHRM2CHRM5
SCHEMBL21597926 0.86 CHRM1 (0.63) CHRM1CHRM2CHRM5
SCHEMBL15630184 0.83 CHRM1 (0.72) CHRM1ALDH1A1GAACHRM5
SCHEMBL14978907 0.83 CHRM1 (0.93) CHRM1ALDH1A1GAASMN1; SMN2CHRM2
SCHEMBL15618929 0.82 CHRM1 (0.63) CHRM1ALDH1A1GAASMN1; SMN2CHRM2
Htl-9936 SCHEMBL14964900 0.80 CHRM1 (1.00) CHRM1ALDH1A1GAACHRM2
Htl-9936 SCHEMBL14978774 0.80 CHRM1 (1.00) CHRM1ALDH1A1GAACHRM2
Htl-9936 SCHEMBL16217938 0.80 CHRM1 (1.00) CHRM1ALDH1A1GAACHRM2

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-10787447-B2 Pharmaceutical compounds HEPTARES THERAPEUTICS LIMITED (GB) 2020-09-29 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-10787447-B2 Pharmaceutical compounds CHRM1, CHRM2, CHRM4 CHRM1 1/4885ALDH1A1 2016/4885GAA 1919/4885

“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.