SCHEMBL30451663

SCHEMBL30451663

C[C@@H](CCC1CCN(C(=O)OC(C)(C)C)CC1)COc1ccc(C(=O)N(C)C)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.52
NR1H2 P55055 3/20 0.47
NR1H3 Q13133 3/20 0.47
SLC2A1 P11166 1/20 0.41
KDM4E B2RXH2 1/20 0.40
PKM P14618 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL20068522 1.00 GPR119 (0.52) GPR119NR1H2NR1H3SLC2A1KDM4E
SCHEMBL22284447 1.00 GPR119 (0.52) GPR119NR1H2NR1H3SLC2A1KDM4E
SCHEMBL22284393 0.90 GPR119 (0.51) GPR119NR1H2NR1H3SLC2A1
SCHEMBL20068597 0.89 NR1H2 (0.46) GPR119NR1H2NR1H3
SCHEMBL22284364 0.89 GPR119 (0.45) GPR119SLC2A1KDM4EPKM
SCHEMBL22284363 0.89 GPR119 (0.45) GPR119SLC2A1KDM4EPKM
SCHEMBL30452097 0.89 GPR119 (0.45) GPR119SLC2A1KDM4EPKM
SCHEMBL25547495 0.89 GPR119 (0.45) GPR119SLC2A1KDM4EPKM
SCHEMBL20068588 0.87 GPR119 (0.54) GPR119NR1H2NR1H3SLC2A1
SCHEMBL20060878 0.86 GPR119 (0.67) GPR119NR1H2NR1H3

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
EP-3526196-B1 ARYL AND HETEROARYL ETHER DERIVATIVES AS LIVER X RECEPTOR BETA AGONISTS MERCK SHARP & DOHME LLC (US) 2026-03-18 EP disclosed
US-11655216-B2 Aryl and heteroaryl ether derivatives as liver X receptor beta agonists, compositions, and their use MERCK SHARP & DOHME LLC (US) 2023-05-23 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-11655216-B2 Aryl and heteroaryl ether derivatives as liver X receptor beta agonists, compositions, and their use NR1H2, NR1H3, NR1H4 GPR119 15/4885NR1H2 1/4885NR1H3 2/4885

“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.