SCHEMBL3497906

SCHEMBL3497906

CC(C)(C)OC(=O)N1CCN(C(=O)C(F)(F)F)C2(C1)CC(C)(C)OC2=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SCD5 Q86SK9 1/20 0.35
NR1H2 P55055 2/20 0.34
MAPT P10636 2/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
HDAC2 Q92769 1/20 0.33
F2RL1 P55085 2/20 0.33
HDAC4 P56524 1/20 0.33
PDK2 Q15119 1/20 0.32
CYP11B2 P19099 1/20 0.32
EPHX2 P34913 1/20 0.32
RORC P51449 2/20 0.32
SPR P35270 1/20 0.32
USP30 Q70CQ3 1/20 0.32

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
SCHEMBL3498063 0.77 MEN1 (0.43) SMN1; SMN2SCD5MAPTPDK2USP30
SCHEMBL3497910 0.74 DDB1 (0.34) USP2SMN1; SMN2DDB1CRBNF2RL1
SCHEMBL3495968 0.72 USP2 (0.43) USP2SMN1; SMN2SCD5NR1H2MAPT
SCHEMBL3497603 0.71 USP2 (0.49) USP2SMN1; SMN2SCD5NR1H2MAPT
SCHEMBL693172 0.69 USP2 (0.55) USP2SMN1; SMN2NR1H2MAPTALDH1A1
SCHEMBL26426348 0.69 GRIN2B (0.42) USP2SMN1; SMN2NR1H2MAPTALDH1A1
SCHEMBL22208198 0.68 USP2 (0.41) USP2SMN1; SMN2SCD5MAPTHDAC2
SCHEMBL24421280 0.68 USP2 (0.46) USP2SMN1; SMN2NR1H2MAPTALDH1A1
SCHEMBL31579613 0.68 HPGD (0.39) USP2SMN1; SMN2SCD5MAPTCYP11B2
SCHEMBL19839394 0.68 DDB1 (0.39) USP2SMN1; SMN2NR1H2MAPTDDB1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100160255-A1 SPIRO-CYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-06-24 US disclosed
US-20100160255-A1 SPIRO-CYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-06-24 US disclosed
US-20100160255-A1 SPIRO-CYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-06-24 US disclosed
EP-1911753-A1 SPIRO-CYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-04-16 EP disclosed
EP-1911753-A1 SPIRO-CYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-04-16 EP 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-20100160255-A1 SPIRO-CYCLIC COMPOUND ACACA, CPT1B, PC USP2 4310/4885SMN1; SMN2 1291/4885SCD5 148/4885

“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.