SCHEMBL25568112

SCHEMBL25568112

C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.38
KDM4E B2RXH2 1/20 0.37
PKM P14618 1/20 0.37
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 0.36
PARP1 P09874 2/20 0.36
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
HCRTR2 O43614 1/20 0.35
STS P08842 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM1A O60341 1/20 0.35
PRMT5 O14744 1/20 0.35
USP30 Q70CQ3 1/20 0.35
OPRD1 P41143 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
SCHEMBL25568115 0.90 GPR119 (0.38) GPR119KDM4EPKMNR1H2NR1H3
SCHEMBL25568114 0.90 GPR119 (0.38) GPR119KDM4EPKMNR1H2NR1H3
SCHEMBL31122948 0.90 GPR119 (0.38) GPR119KDM4EPKMNR1H2NR1H3
SCHEMBL25568127 0.89 TACR1 (0.40) GPR119KDM4EPKMNR1H2NR1H3
SCHEMBL21987446 0.89 STS (0.39) GPR119KDM4EPKMNR1H2NR1H3
SCHEMBL21987444 0.89 STS (0.39) GPR119KDM4EPKMNR1H2NR1H3
SCHEMBL21987443 0.89 STS (0.39) GPR119KDM4EPKMNR1H2NR1H3
SCHEMBL25568111 0.89 TACR1 (0.40) GPR119KDM4EPKMNR1H2NR1H3
SCHEMBL21987812 0.88 KDM4E (0.40) GPR119KDM4EPKMNR1H2NR1H3
SCHEMBL21987810 0.88 KDM4E (0.40) GPR119KDM4EPKMNR1H2NR1H3

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-20230159517-A1 CHROMANE AMIDINE MONOBACTAM COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS MERCK SHARP & DOHME LLC (US) 2023-05-25 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-20230159517-A1 CHROMANE AMIDINE MONOBACTAM COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS TCOF1, SLC10A2, PAM GPR119 3158/4885KDM4E 4015/4885PKM 2797/4885

“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.