SCHEMBL4410437

SCHEMBL4410437

CC(C)(C)OC(=O)N1CCN(C(=O)c2cc(F)ccc2F)C(CO)C1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.44
PARP1 P09874 1/20 0.42
PAK1 Q13153 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.40
NAAA Q02083 1/20 0.40
MAPT P10636 2/20 0.40
KAT7 O95251 1/20 0.39
CCR3 P51677 1/20 0.39
USP30 Q70CQ3 1/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 1/20 0.38
THRB P10828 1/20 0.38
TRPV3 Q8NET8 1/20 0.38
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38
SETD7 Q8WTS6 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
SCHEMBL4409895 0.91 KAT7 (0.44) GPR119PARP1MAPTKAT7USP30
SCHEMBL4411290 0.91 USP30 (0.46) GPR119PARP1PAK1MAPTKAT7
SCHEMBL4418322 0.90 USP30 (0.47) GPR119PARP1KAT7USP30TRPV3
SCHEMBL4410912 0.89 MCL1 (0.42) GPR119PARP1MAPTKAT7NR1H2
SCHEMBL4417382 0.89 CPS1 (0.48) PARP1CCR3
SCHEMBL4407351 0.87 GPR119 (0.43) GPR119PARP1MAPTKAT7LMNA
SCHEMBL4408769 0.86 USP30 (0.47) PARP1PAK1MAPTKAT7USP30
SCHEMBL24558215 0.84 USP30 (0.41) GPR119PARP1KAT7USP30TRPV3
SCHEMBL4415927 0.84 KAT7 (0.44) GPR119PARP1MAPTKAT7USP30
SCHEMBL12832455 0.84 NR1H2 (0.45) PARP1KAT7USP30NR1H2SETD7

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-20090318412-A1 Tricyclic heterocyclic compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-24 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-20090318412-A1 Tricyclic heterocyclic compound and use thereof HTR2C, HTR2A, HTR5A GPR119 234/4885PARP1 2847/4885PAK1 2028/4885

“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.