SCHEMBL22472884

SCHEMBL22472884

CCOC(=O)N1C(C)CC(N2CCC(C(=O)NCC(C)C)CC2)CC1C

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 10/20 0.46
EPHX2 P34913 1/20 0.40
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL22472879 0.90 EPHX2 (0.39) CHRM1EPHX2LMNAGAARAB9A
SCHEMBL21597937 0.85 CHRM1 (0.48) CHRM1EPHX2SMN1; SMN2ALDH1A1
SCHEMBL22472885 0.84 CHRM1 (0.47) CHRM1EPHX2GAASMN1; SMN2ALDH1A1
SCHEMBL14978888 0.83 CHRM1 (0.62) CHRM1LMNAGAASMN1; SMN2MEN1
SCHEMBL14978775 0.79 CHRM1 (0.65) CHRM1LMNAGAASMN1; SMN2ALDH1A1
SCHEMBL14964864 0.79 CHRM1 (0.65) CHRM1LMNAGAASMN1; SMN2ALDH1A1
SCHEMBL14978767 0.79 CHRM1 (0.65) CHRM1LMNAGAASMN1; SMN2ALDH1A1
SCHEMBL22472944 0.78 CHRM1 (0.67) CHRM1GAASMN1; SMN2ALDH1A1
SCHEMBL15619002 0.76 CHRM4 (0.49) CHRM1EPHX2LMNAGAASMN1; SMN2
SCHEMBL22472905 0.76 ALDH1A1 (0.53) CHRM1LMNASMN1; SMN2MEN1KMT2A

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 1/4885EPHX2 1688/4885LMNA 3439/4885

“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.