SCHEMBL26430591

SCHEMBL26430591

CC[C@@H]1C[C@@H](CO)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.48
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
ATM Q13315 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
PARP1 P09874 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL26430598 0.89 NR1H2 (0.44) NR1H2CHRM2CHRM1CHRM3ATM
SCHEMBL5255605 0.86 SMN1; SMN2 (0.38) NR1H2CHRM2CHRM1CHRM3ATM
SCHEMBL19158003 0.83 ATM (0.42) CHRM2CHRM1CHRM3ATMSMN1; SMN2
SCHEMBL24121385 0.83 ATM (0.42) CHRM2CHRM1CHRM3ATMSMN1; SMN2
SCHEMBL23695127 0.83 HSD17B10 (0.41) NR1H2CHRM2CHRM1CHRM3ATM
SCHEMBL23695128 0.83 HSD17B10 (0.41) NR1H2CHRM2CHRM1CHRM3ATM
SCHEMBL23895462 0.82 CHRM2 (0.40) NR1H2CHRM2CHRM1CHRM3ATM
SCHEMBL9310923 0.82 CHRM2 (0.46) NR1H2CHRM2CHRM1CHRM3ATM
SCHEMBL19189558 0.82 CHRM2 (0.46) NR1H2CHRM2CHRM1CHRM3ATM
SCHEMBL9311613 0.82 CHRM2 (0.46) NR1H2CHRM2CHRM1CHRM3ATM

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-11639350-B2 Heteroaryldihydropyrimidine derivatives and methods of treating hepatitis B infections JANSSEN PHARMACEUTICA NV (BE) 2023-05-02 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-11639350-B2 Heteroaryldihydropyrimidine derivatives and methods of treating hepatitis B infections HCCS, HAVCR2, NR1H4 NR1H2 37/4885CHRM2 4712/4885CHRM1 4601/4885

“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.