SCHEMBL26430589

SCHEMBL26430589

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

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ BTK Q06187 1/20 0.43
▸ HPGD P15428 1/20 0.40
▸ RECQL P46063 1/20 0.39
▸ CHRM2 P08172 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ CHRM3 P20309 1/20 0.38
▸ ATM Q13315 2/20 0.37
▸ ALDH1A1 P00352 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
SCHEMBL1439128 1.00 HSD17B10 (0.50) HSD17B10SMN1; SMN2BTKHPGDRECQL
SCHEMBL24047701 1.00 HSD17B10 (0.50) HSD17B10SMN1; SMN2BTKHPGDRECQL
SCHEMBL23695127 0.89 HSD17B10 (0.41) HSD17B10SMN1; SMN2HPGDRECQLCHRM2
SCHEMBL23695128 0.89 HSD17B10 (0.41) HSD17B10SMN1; SMN2HPGDRECQLCHRM2
SCHEMBL31320075 0.87 SMN1; SMN2 (0.41) HSD17B10SMN1; SMN2HPGDRECQLCHRM2
SCHEMBL17730541 0.87 HSD17B10 (0.49) HSD17B10SMN1; SMN2BTKHPGDRECQL
SCHEMBL23487150 0.87 SMN1; SMN2 (0.41) HSD17B10SMN1; SMN2HPGDRECQLCHRM2
SCHEMBL29601341 0.87 HSD17B10 (0.49) HSD17B10SMN1; SMN2BTKHPGDRECQL
SCHEMBL29785811 0.86 HSD17B10 (0.48) HSD17B10SMN1; SMN2BTKHPGDRECQL
SCHEMBL25866393 0.85 HSD17B10 (0.43) HSD17B10SMN1; SMN2BTKCHRM2CHRM1

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 HSD17B10 166/4885SMN1; SMN2 4624/4885BTK 2559/4885

“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.

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