SCHEMBL27433296

SCHEMBL27433296

CC(C)(C)OC(=O)N1CCn2c(nc3c(CO)cccc32)C1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
CHRM1 P11229 1/20 0.46
CHRM3 P20309 1/20 0.46
NR1H2 P55055 1/20 0.42
ACHE P22303 1/20 0.41
HTT P42858 1/20 0.41
PARP1 P09874 2/20 0.41
LIPG Q9Y5X9 1/20 0.41
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.39
CXCR2 P25025 1/20 0.39
DTYMK P23919 2/20 0.39
TNKS2 Q9H2K2 1/20 0.38
PARP2 Q9UGN5 1/20 0.38
GBA1 P04062 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL27432394 0.85 NR1H2 (0.45) CHRM2CHRM4CHRM1CHRM3NR1H2
SCHEMBL27432029 0.84 NR1H2 (0.44) CHRM2CHRM4CHRM1CHRM3NR1H2
SCHEMBL27433186 0.83 KLKB1 (0.38) CHRM2CHRM4CHRM1CHRM3NR1H2
SCHEMBL27433294 0.81 MEN1 (0.43) CHRM2CHRM4CHRM1CHRM3NR1H2
SCHEMBL31029030 0.81 GRM2 (0.47) CHRM2CHRM4CHRM1CHRM3HTT
SCHEMBL27432033 0.81 GRM2 (0.43) CHRM2CHRM4CHRM1CHRM3HTT
SCHEMBL31028998 0.81 GRM2 (0.43) CHRM2CHRM4CHRM1CHRM3HTT
SCHEMBL27433104 0.81 GRM2 (0.47) CHRM2CHRM4CHRM1CHRM3HTT
SCHEMBL27433298 0.79 CYP3A4 (0.40) PARP1CXCR2
SCHEMBL20139779 0.79 TSHR (0.62) CHRM2CHRM4CHRM1CHRM3NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4638455-A1 HETEROCYCLIC GLP-1 AGONISTS Gasherbrum Bio, Inc. (US) 2025-10-29 EP disclosed
WO-2024138048-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. (US) 2024-06-27 WO disclosed
WO-2024138048-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. (US) 2024-06-27 WO disclosed