SCHEMBL22472885

SCHEMBL22472885

CCOC(=O)N1C(C)CC(N2CCC(C(=O)NCC3CCC3)CC2)CC1C

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 7/20 0.47
EPHX1 P07099 1/20 0.43
GAA P10253 2/20 0.42
MAPT P10636 1/20 0.41
EPHX2 P34913 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL22472869 0.91 MAPT (0.45) CHRM1EPHX1GAAMAPTEPHX2
SCHEMBL21597906 0.86 CHRM1 (0.49) CHRM1EPHX1GAAMAPTEPHX2
SCHEMBL22472884 0.84 CHRM1 (0.46) CHRM1GAAEPHX2ALDH1A1SMN1; SMN2
SCHEMBL14978890 0.80 CHRM1 (0.65) CHRM1EPHX1GAAMAPTL3MBTL1
SCHEMBL22472944 0.79 CHRM1 (0.67) CHRM1GAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL14978899 0.77 CHRM1 (0.65) CHRM1EPHX1GAAMAPTL3MBTL1
SCHEMBL22472868 0.76 MAPT (0.43) CHRM1EPHX1GAAMAPTEPHX2
SCHEMBL22472905 0.76 ALDH1A1 (0.53) CHRM1MAPTL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL14978908 0.76 CHRM1 (0.66) CHRM1GAAMAPTL3MBTL1ALDH1A1
SCHEMBL15630428 0.75 CHRM4 (0.49) CHRM1EPHX1GAAMAPTEPHX2

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 1/4885EPHX1 978/4885GAA 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.