SCHEMBL29587713

SCHEMBL29587713

COC(=O)C1C(O)C[C@@H](C)N1C(=O)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.59
CACNA1G O43497 1/20 0.48
CACNA1H O95180 1/20 0.48
CACNA1I Q9P0X4 1/20 0.48
HCRTR2 O43614 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
CPB1 P15086 1/20 0.46
CYP2C19 P33261 3/20 0.45
CYP2C9 P11712 2/20 0.45
ALDH1A1 P00352 2/20 0.45
CYP1A2 P05177 1/20 0.45
POLB P06746 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
TSHR P16473 1/20 0.45
PSEN1 P49768 1/20 0.44
PSEN2 P49810 1/20 0.44
APH1B Q8WW43 1/20 0.44

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
SCHEMBL29587180 0.88 HCRTR2 (0.57) HTR2CCACNA1GCACNA1HCACNA1IHCRTR2
SCHEMBL29979939 0.85 HTR2C (0.58) HTR2CCACNA1GCACNA1HCACNA1ISMN1; SMN2
SCHEMBL17234175 0.85 HTR2C (0.58) HTR2CCACNA1GCACNA1HCACNA1ISMN1; SMN2
SCHEMBL2389760 0.84 HTR2C (0.64) HTR2CCACNA1GCACNA1HCACNA1IHCRTR2
SCHEMBL8606286 0.82 HTR2C (0.70) HTR2CCACNA1GCACNA1HCACNA1IHCRTR2
SCHEMBL9546447 0.81 HTR2C (0.57) HTR2CCACNA1GCACNA1HCACNA1ISMN1; SMN2
SCHEMBL12282046 0.81 HTR2C (0.51) HTR2CCACNA1GCACNA1HCACNA1IHCRTR2
SCHEMBL12282385 0.81 HTR2C (0.51) HTR2CCACNA1GCACNA1HCACNA1IHCRTR2
SCHEMBL30591131 0.80 HTR2C (0.47) HTR2CSMN1; SMN2NPC1RAB9APOLB
SCHEMBL15719445 0.80 HTR2C (0.47) HTR2CSMN1; SMN2NPC1RAB9APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12552767-B2 3-heteroaryl pyrrolidine and piperidine orexin receptor agonists MERCK SHARP & DOHME LLC (US) 2026-02-17 US disclosed
EP-3924058-B1 5-ALKYL PYRROLIDINE OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2026-01-07 EP disclosed
US-12312332-B2 Heteroaryl pyrrolidine and piperidine orexin receptor agonists MERCK SHARP & DOHME LLC (US) 2025-05-27 US disclosed
EP-4010314-B1 HETEROARYL PYRROLIDINE AND PIPERIDINE OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2024-02-28 EP disclosed
US-20240002359-A1 3-HETEROARYL PYRROLIDINE AND PIPERIDINE OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2024-01-04 US disclosed
EP-4255429-A1 3-HETEROARYL PYRROLIDINE AND PIPERIDINE OREXIN RECEPTOR AGONISTS Merck Sharp & Dohme LLC (US) 2023-10-11 EP disclosed
US-20230018413-A1 HETEROARYL PYRROLIDINE AND PIPERIDINE OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME CORP. (US) 2023-01-19 US disclosed
WO-2022119888-A1 3-HETEROARYL PYRROLIDINE AND PIPERIDINE OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME CORP. (US) 2022-06-09 WO 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 (4 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-12552767-B2 3-heteroaryl pyrrolidine and piperidine orexin receptor agonists HCRTR2, HCRTR1, NPY1R HTR2C 25/4885CACNA1G 805/4885CACNA1H 851/4885
US-20240002359-A1 3-HETEROARYL PYRROLIDINE AND PIPERIDINE OREXIN RECEPTOR AGONISTS HCRTR2, HCRTR1, OXTR HTR2C 34/4885CACNA1G 1659/4885CACNA1H 1463/4885
US-12312332-B2 Heteroaryl pyrrolidine and piperidine orexin receptor agonists HCRTR2, HCRTR1, OXTR HTR2C 41/4885CACNA1G 1873/4885CACNA1H 1528/4885
US-20230018413-A1 HETEROARYL PYRROLIDINE AND PIPERIDINE OREXIN RECEPTOR AGONISTS HCRTR2, HCRTR1, OXTR HTR2C 41/4885CACNA1G 1873/4885CACNA1H 1528/4885

“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.