SCHEMBL4413014

SCHEMBL4413014

CC(C)(C)OC(=O)N1CCN2C(=O)c3c(cccc3-c3ccoc3)OCC2C1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.40
USP30 Q70CQ3 3/20 0.39
SMARCA2 P51531 1/20 0.36
SMARCA4 P51532 1/20 0.36
PBRM1 Q86U86 1/20 0.36
ABCB1 P08183 1/20 0.35
TP53 P04637 1/20 0.35
EGFR P00533 3/20 0.35
SRC P12931 3/20 0.35
PDK4 Q16654 1/20 0.35
BACE1 P56817 2/20 0.34
HDAC6 Q9UBN7 2/20 0.34
ABL1 P00519 2/20 0.34
ABL2 P42684 2/20 0.34
SETD7 Q8WTS6 1/20 0.34
SCN9A Q15858 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
BRD4 O60885 1/20 0.33
PIK3CA P42336 1/20 0.33

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
SCHEMBL4411286 0.89 USP30 (0.44) USP30SMARCA2SMARCA4PBRM1ABCB1
SCHEMBL4418327 0.87 USP30 (0.40) USP30SMARCA2SMARCA4PBRM1TP53
SCHEMBL4415912 0.85 USP30 (0.41) GPR119USP30SMARCA2SMARCA4PBRM1
SCHEMBL4410015 0.85 SCN9A (0.42) GPR119USP30SMARCA2SMARCA4PBRM1
SCHEMBL4408961 0.82 USP30 (0.43) USP30SMARCA2SMARCA4PBRM1ABCB1
SCHEMBL4412319 0.82 USP30 (0.43) USP30TP53SCN9A
SCHEMBL4408213 0.82 USP30 (0.43) GPR119USP30SMARCA2SMARCA4PBRM1
SCHEMBL4410012 0.82 USP30 (0.42) USP30TP53BACE1SCN9A
SCHEMBL4415998 0.81 USP30 (0.42) USP30TP53HDAC6SCN9AHDAC8
SCHEMBL4411273 0.81 USP30 (0.44) GPR119USP30TP53SCN9A

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 234/4885USP30 4369/4885SMARCA2 3907/4885

“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.