SCHEMBL25993448

SCHEMBL25993448

C#Cc1cccc(N2C[C@@H]3C[C@H]2CN3C(=O)OC(C)(C)C)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.45
GPR119 Q8TDV5 1/20 0.44
HSD11B1 P28845 1/20 0.43
HDAC1 Q13547 1/20 0.43
NR1H2 P55055 7/20 0.40
AR P10275 1/20 0.40
FAAH O00519 1/20 0.40
NR1H3 Q13133 6/20 0.40
RET P07949 2/20 0.40
IDH1 O75874 1/20 0.39
F13A1 P00488 1/20 0.39
TGM2 P21980 1/20 0.39
TGM1 P22735 1/20 0.39
MAPK8 P45983 1/20 0.38

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
SCHEMBL25999573 1.00 PARP1 (0.45) PARP1GPR119HSD11B1HDAC1NR1H2
SCHEMBL1367657 0.89 AR (0.49) PARP1GPR119HSD11B1HDAC1NR1H2
SCHEMBL1367658 0.89 AR (0.49) PARP1GPR119HSD11B1HDAC1NR1H2
SCHEMBL11963216 0.84 PARP1 (0.48) PARP1GPR119HSD11B1HDAC1NR1H2
SCHEMBL4931842 0.84 PARP1 (0.48) PARP1GPR119HSD11B1HDAC1NR1H2
SCHEMBL12143027 0.84 GPR119 (0.51) PARP1GPR119HSD11B1HDAC1NR1H2
SCHEMBL22772747 0.83 FAAH (0.48) PARP1GPR119HSD11B1HDAC1NR1H2
SCHEMBL13118692 0.83 FAAH (0.48) PARP1GPR119HSD11B1HDAC1NR1H2
SCHEMBL25352990 0.83 HCRTR1 (0.39) FAAH
SCHEMBL30818801 0.82 PARP1 (0.54) PARP1GPR119HSD11B1HDAC1NR1H2

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
US-20230257372-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2023-08-17 US disclosed
US-20230257372-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2023-08-17 US disclosed
EP-4185586-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Chong Kun Dang Pharmaceutical Corp. (KR) 2023-05-31 EP 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-20230257372-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME HDAC6, HDAC1, HDAC3 PARP1 138/4885GPR119 901/4885HSD11B1 266/4885

“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.