SCHEMBL15880038

SCHEMBL15880038

CC(C)(C)OC(=O)N1CCC(=O)C[C@@H]1Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.53
NR1H3 Q13133 2/20 0.53
PARP1 P09874 1/20 0.46
DPP4 P27487 1/20 0.46
HDAC1 Q13547 1/20 0.45
KLK7 P49862 6/20 0.45
GPR119 Q8TDV5 2/20 0.43
STS P08842 1/20 0.42
ABCB1 P08183 1/20 0.42
KLK5 Q9Y337 5/20 0.42
ABHD6 Q9BV23 1/20 0.41
DAGLA Q9Y4D2 1/20 0.41
PRSS1 P07477 2/20 0.41
PRSS2 P07478 2/20 0.41
PRSS3 P35030 2/20 0.41
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40

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
SCHEMBL582271 1.00 NR1H2 (0.53) NR1H2NR1H3PARP1DPP4HDAC1
SCHEMBL15353299 1.00 NR1H2 (0.53) NR1H2NR1H3PARP1DPP4HDAC1
SCHEMBL18589365 0.88 OPRK1 (0.43) NR1H2NR1H3PARP1STS
SCHEMBL15358971 0.88 CCR3 (0.44) NR1H2NR1H3PARP1DPP4
SCHEMBL582498 0.88 OPRK1 (0.43) NR1H2NR1H3PARP1STS
SCHEMBL29997923 0.84 NR1H2 (0.50) NR1H2NR1H3PARP1DPP4HDAC1
SCHEMBL28334137 0.84 NR1H2 (0.56) NR1H2NR1H3PARP1DPP4HDAC1
SCHEMBL28334140 0.84 NR1H2 (0.56) NR1H2NR1H3PARP1DPP4HDAC1
SCHEMBL28052129 0.84 JAK2 (0.45) NR1H2NR1H3PARP1STSJAK2
SCHEMBL14630965 0.84 PSEN1 (0.53) PARP1

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-9115151-B2 Substituted 2,10-dihydro-9-oxa-1,2,4A-triazaphenanthren-3-ones and uses thereof ABBVIE INC. (US) 2015-08-25 US disclosed
US-20140206663-A1 TRIAZINONE COMPOUNDS WUXI APPTECH (SHANGHAI) CO., LTD. (CN) 2014-07-24 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-20140206663-A1 TRIAZINONE COMPOUNDS THPO, IL5, CYP11B2 NR1H2 211/4885NR1H3 311/4885PARP1 1420/4885

“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.