SCHEMBL22472864

SCHEMBL22472864

COC(=O)N1C(C)CC(N2CCC(c3cccnc3OC)CC2)CC1C

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 7/20 0.43
SSTR1 P30872 4/20 0.43
PDE10A Q9Y233 2/20 0.43
IDO1 P14902 1/20 0.41
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40

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
SCHEMBL22472878 0.91 CHRM4 (0.48) SSTR4SSTR1IDO1CHRM2CHRM4
SCHEMBL22449311 0.87 IDO1 (0.42) SSTR4SSTR1PDE10AIDO1CHRM2
SCHEMBL27176076 0.79 CHRM4 (0.40) PDE10AIDO1CHRM2CHRM4
SCHEMBL22472943 0.78 ALDH1A1 (0.38) CHRM2CHRM4
SCHEMBL21597912 0.78 CHRM4 (0.47) IDO1CHRM2CHRM4
SCHEMBL20473483 0.78 CHRM2 (0.49) CHRM2CHRM4
SCHEMBL15942408 0.77 CHRM4 (0.66) CHRM2CHRM4
SCHEMBL7957728 0.77 IDO1 (0.38) IDO1
SCHEMBL22472923 0.75 HTR1A (0.47) PDE10A
SCHEMBL15942379 0.74 CHRM4 (0.56) CHRM2CHRM4

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 SSTR4 234/4885SSTR1 207/4885PDE10A 450/4885

“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.