SCHEMBL4410912

SCHEMBL4410912

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

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.42
MAPT P10636 1/20 0.41
GPR119 Q8TDV5 2/20 0.41
PARP1 P09874 1/20 0.41
EPHX2 P34913 1/20 0.40
TACR1 P25103 7/20 0.39
P2RX7 Q99572 1/20 0.39
MC4R P32245 1/20 0.38
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38
KAT7 O95251 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
ENPP2 Q13822 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
SCHEMBL4410437 0.89 GPR119 (0.44) MAPTGPR119PARP1NR1H2NR1H3
SCHEMBL4411290 0.88 USP30 (0.46) MAPTGPR119PARP1KAT7CNR1
SCHEMBL4409895 0.88 KAT7 (0.44) MAPTGPR119PARP1NR1H2NR1H3
SCHEMBL4418322 0.87 USP30 (0.47) GPR119PARP1NR1H2NR1H3KAT7
SCHEMBL4417382 0.86 CPS1 (0.48) PARP1EPHX2
SCHEMBL4407351 0.85 GPR119 (0.43) MAPTGPR119PARP1KAT7
SCHEMBL4408769 0.83 USP30 (0.47) MAPTPARP1KAT7CNR1
SCHEMBL24558215 0.82 USP30 (0.41) GPR119PARP1NR1H2KAT7
SCHEMBL4415927 0.82 KAT7 (0.44) MAPTGPR119PARP1KAT7
SCHEMBL12832455 0.81 NR1H2 (0.45) PARP1NR1H2KAT7

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 MCL1 2928/4885MAPT 3712/4885GPR119 234/4885

“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.