SCHEMBL4412331

SCHEMBL4412331

CC(C)(C)OC(=O)N1CCN2Cc3ccc(-c4ccccc4)cc3OCC2C1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 10/20 0.51
ABCB1 P08183 1/20 0.41
GPR119 Q8TDV5 1/20 0.40
CRBN Q96SW2 1/20 0.40
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
EGFR P00533 1/20 0.39
SRC P12931 1/20 0.39
SCD5 Q86SK9 1/20 0.39
BACE1 P56817 1/20 0.39

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
SCHEMBL4406512 0.92 USP30 (0.49) USP30ABCB1GPR119CRBNPTPN2
SCHEMBL4407107 0.87 MAPK1 (0.44) USP30ABCB1GPR119
SCHEMBL4406534 0.86 ESR2 (0.40) USP30GPR119SCD5
SCHEMBL4409669 0.81 TGFBR1 (0.38) USP30GPR119
SCHEMBL4410166 0.81 USP30 (0.51) USP30ABCB1CRBNEGFRSRC
SCHEMBL3277720 0.79 USP30 (0.58) USP30GPR119CRBNPTPN2PTPN1
SCHEMBL4411026 0.79 USP30 (0.40) USP30SCD5BACE1
SCHEMBL4418602 0.79 RIPK1 (0.46) USP30
SCHEMBL4409890 0.78 MTNR1A (0.44) EGFRSRC
SCHEMBL4410917 0.78 USP30 (0.49) USP30ABCB1GPR119CRBNEGFR

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 USP30 4369/4885ABCB1 848/4885GPR119 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.