SCHEMBL26398488

SCHEMBL26398488

C[C@]1(c2ccccc2)OC(=O)N2CCC[C@H]21

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
HSD11B1 P28845 3/20 0.40
CHRM2 P08172 9/20 0.40
CHRM3 P20309 9/20 0.40
CHRM4 P08173 8/20 0.39
CHRM5 P08912 8/20 0.39
CHRM1 P11229 8/20 0.39
TNKS O95271 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
ALDH1A1 P00352 2/20 0.37
DHODH Q02127 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
SCHEMBL25971538 0.87 KDM4E (0.36) SMN1; SMN2HSD11B1KDM4EMAPTKDM4C
SCHEMBL25988291 0.83 BACE1 (0.40) HSD11B1
SCHEMBL23052957 0.82 NPSR1 (0.50) SMN1; SMN2HSD11B1CHRM2CHRM3CHRM4
SCHEMBL25971004 0.71 MCOLN3 (0.38) SMN1; SMN2HSD11B1CHRM2CHRM3CHRM4
SCHEMBL18481610 0.69 CHRM2 (0.38) CHRM2CHRM3CHRM4CHRM5CHRM1
SCHEMBL22458648 0.69 CHRM2 (0.38) CHRM2CHRM3CHRM4CHRM5CHRM1
SCHEMBL26999038 0.69 CHRM2 (0.38) CHRM2CHRM3CHRM4CHRM5CHRM1
SCHEMBL13910978 0.69 CHRM2 (0.38) CHRM2CHRM3CHRM4CHRM5CHRM1
SCHEMBL12513017 0.69 CHRM2 (0.38) CHRM2CHRM3CHRM4CHRM5CHRM1
SCHEMBL25980370 0.69 APP (0.38) HSD11B1CHRM2CHRM3CHRM4CHRM5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312630-A1 PHOSPHORAMIDITE SYNTHESIS ON-DEMAND AARHUS UNIVERSITET (DK) 2023-10-05 US disclosed
US-20230312630-A1 PHOSPHORAMIDITE SYNTHESIS ON-DEMAND AARHUS UNIVERSITET (DK) 2023-10-05 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-20230312630-A1 PHOSPHORAMIDITE SYNTHESIS ON-DEMAND RNGTT, PPA1, PNP SMN1; SMN2 1739/4885HSD11B1 4461/4885CHRM2 4675/4885

“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.