SCHEMBL3332874

SCHEMBL3332874

CC(C)(C)OC(=O)N1CCO[C@@H]([C@H](O)c2ccccc2)C1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 5/20 0.45
GPR119 Q8TDV5 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
USP2 O75604 1/20 0.43
ATM Q13315 1/20 0.42
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 1/20 0.41
HPGDS O60760 1/20 0.40
RORC P51449 1/20 0.40
PRMT5 O14744 2/20 0.40
WDR77 Q9BQA1 2/20 0.40
GAA P10253 1/20 0.39
THRB P10828 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
SCHEMBL3329651 1.00 USP30 (0.45) USP30GPR119SMN1; SMN2USP2ATM
SCHEMBL3329274 1.00 USP30 (0.45) USP30GPR119SMN1; SMN2USP2ATM
SCHEMBL3185439 1.00 USP30 (0.45) USP30GPR119SMN1; SMN2USP2ATM
SCHEMBL5705724 0.88 USP2 (0.41) GPR119SMN1; SMN2USP2JAK2JAK1
SCHEMBL970289 0.87 STS (0.44) USP30SMN1; SMN2
SCHEMBL5289397 0.87 PDE4B (0.40) USP30GPR119SMN1; SMN2USP2KDM4E
SCHEMBL970288 0.87 STS (0.44) USP30SMN1; SMN2
SCHEMBL3329066 0.87 GPR119 (0.44) USP30GPR119SMN1; SMN2USP2HPGDS
SCHEMBL3327776 0.87 GPR119 (0.44) USP30GPR119SMN1; SMN2USP2HPGDS
SCHEMBL5289408 0.87 PDE4B (0.40) USP30GPR119SMN1; SMN2USP2KDM4E

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-20100137316-A1 Morpholine Compounds, Pharmaceutically Acceptable Salts Thereof, Pharmaceutical Compositions, and Methods Of Use Thereof FISH PAUL VINCENT 2010-06-03 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-20100137316-A1 Morpholine Compounds, Pharmaceutically Acceptable Salts Thereof, Pharmaceutical Compositions, and Methods Of Use Thereof OPRL1, UGT1A1, HTR3B USP30 3956/4885GPR119 1216/4885SMN1; SMN2 5/4885

“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.