SCHEMBL19518166

SCHEMBL19518166

CC(C)(C)OC(=O)N1CCC2(CC1)CN(C1CC1)C(=O)C(C)(C)O2

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TP53 P04637 1/20 0.39
HRH3 Q9Y5N1 7/20 0.38
RECQL P46063 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
CTSD P07339 1/20 0.37
CTSE P14091 1/20 0.37
BACE1 P56817 1/20 0.37
HPGD P15428 1/20 0.37
FPR2 P25090 1/20 0.36
GPR119 Q8TDV5 1/20 0.36

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
SCHEMBL17324919 0.80 USP2 (0.40) USP2SMN1; SMN2DDB1CRBNGPR119
SCHEMBL17324920 0.80 USP2 (0.40) USP2SMN1; SMN2RECQLKDM4EMAPT
SCHEMBL4542086 0.80 USP2 (0.40) USP2SMN1; SMN2TP53HRH3RECQL
SCHEMBL19518174 0.79 OPRM1 (0.49) USP2SMN1; SMN2TP53HRH3RECQL
SCHEMBL20555716 0.79 OPRM1 (0.49) USP2SMN1; SMN2TP53HRH3RECQL
SCHEMBL17324903 0.79 OPRM1 (0.49) USP2SMN1; SMN2TP53HRH3RECQL
SCHEMBL20555671 0.78 USP2 (0.38) USP2SMN1; SMN2DDB1CRBNGPR119
SCHEMBL20475505 0.77 HRH3 (0.50) USP2SMN1; SMN2TP53HRH3RECQL
SCHEMBL23481174 0.77 HRH3 (0.43) USP2SMN1; SMN2TP53HRH3RECQL
SCHEMBL20621868 0.76 USP2 (0.36) USP2SMN1; SMN2KDM4EMAPTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3149006-B1 ALKYL DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS SA (ES) 2020-09-09 EP disclosed
EP-3149006-B1 ALKYL DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS SA (ES) 2020-09-09 EP disclosed
US-20190177337-A1 Alkyl derivatives of 1-oxa-4,9-diazaspiro undecane compounds having multimodal activity against pain ESTEVE PHARMACEUTICALS, S.A. (ES) 2019-06-13 US disclosed
US-20190177337-A1 Alkyl derivatives of 1-oxa-4,9-diazaspiro undecane compounds having multimodal activity against pain ESTEVE PHARMACEUTICALS, S.A. (ES) 2019-06-13 US disclosed
US-10246465-B2 Alkyl derivatives of 1-oxa-4,9-diazaspiro undecane compounds having multimodal activity against pain LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2019-04-02 US disclosed
US-10246465-B2 Alkyl derivatives of 1-oxa-4,9-diazaspiro undecane compounds having multimodal activity against pain LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2019-04-02 US disclosed
US-20170313723-A1 Alkyl derivatives of 1-oxa-4,9-diazaspiro undecane compounds having multimodal activity against pain LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2017-11-02 US disclosed
US-20170313723-A1 Alkyl derivatives of 1-oxa-4,9-diazaspiro undecane compounds having multimodal activity against pain LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2017-11-02 US disclosed
US-20170313723-A1 Alkyl derivatives of 1-oxa-4,9-diazaspiro undecane compounds having multimodal activity against pain LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2017-11-02 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 (3 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-10246465-B2 Alkyl derivatives of 1-oxa-4,9-diazaspiro undecane compounds having multimodal activity against pain OPRD1, OPRM1, SIGMAR1 USP2 2147/4885SMN1; SMN2 708/4885TP53 4857/4885
US-20190177337-A1 Alkyl derivatives of 1-oxa-4,9-diazaspiro undecane compounds having multimodal activity against pain OPRD1, OPRM1, SIGMAR1 USP2 2147/4885SMN1; SMN2 708/4885TP53 4857/4885
US-20170313723-A1 Alkyl derivatives of 1-oxa-4,9-diazaspiro undecane compounds having multimodal activity against pain OPRD1, SIGMAR1, OPRM1 USP2 1847/4885SMN1; SMN2 775/4885TP53 4840/4885

“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.