SCHEMBL30964844

SCHEMBL30964844

Cc1ccc(N2CC3CC2CN3C(=O)OC(C)(C)C)cc1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.45
HSD11B1 P28845 1/20 0.44
PARP1 P09874 1/20 0.43
HDAC1 Q13547 1/20 0.42
CYP1A2 P05177 1/20 0.40
POLB P06746 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
IDH1 O75874 1/20 0.40
F13A1 P00488 1/20 0.39
TGM2 P21980 1/20 0.39
TGM1 P22735 1/20 0.39
AR P10275 3/20 0.39
RET P07949 2/20 0.38
SPR P35270 1/20 0.38
MAPK8 P45983 1/20 0.37
NR1H2 P55055 2/20 0.37
NR1H3 Q13133 2/20 0.37
FAAH O00519 1/20 0.37
LMNA P02545 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
SCHEMBL30964970 0.89 NR1H2 (0.44) GPR119HSD11B1PARP1HDAC1CYP1A2
SCHEMBL1016380 0.84 GPR119 (0.45) GPR119HSD11B1PARP1HDAC1CYP1A2
SCHEMBL1016379 0.84 GPR119 (0.45) GPR119HSD11B1PARP1HDAC1CYP1A2
SCHEMBL25330300 0.84 GPR119 (0.45) GPR119HSD11B1PARP1HDAC1IDH1
SCHEMBL4530941 0.82 HDAC1 (0.49) GPR119HSD11B1PARP1HDAC1F13A1
SCHEMBL25899695 0.82 GPR119 (0.50) GPR119HSD11B1PARP1HDAC1CYP1A2
SCHEMBL30818801 0.81 PARP1 (0.54) GPR119HSD11B1PARP1HDAC1F13A1
SCHEMBL12143027 0.81 GPR119 (0.51) GPR119HSD11B1PARP1HDAC1CYP1A2
SCHEMBL1199629 0.80 GPR119 (0.50) GPR119HSD11B1PARP1HDAC1F13A1
SCHEMBL1199627 0.80 GPR119 (0.50) GPR119HSD11B1PARP1HDAC1F13A1

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
US-20240245673-A1 Papain-like protease (PLpro) inhibitors PFIZER INC. (US) 2024-07-25 US disclosed
WO-2024121779-A1 PAPAIN-LIKE PROTEASE (PLPRO) INHIBITORS PFIZER INC. (US) 2024-06-13 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 (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-20240245673-A1 Papain-like protease (PLpro) inhibitors PREP, PEPD, ACE GPR119 3702/4885HSD11B1 677/4885PARP1 952/4885

“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.