SCHEMBL18971233

SCHEMBL18971233

CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CC[C@H]1CN(c1cc(Cl)ncn1)C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 2/20 0.41
▸ JAK3 P52333 1/20 0.41
▸ BTK Q06187 1/20 0.41
▸ RET P07949 3/20 0.40
▸ MAP4K4 O95819 2/20 0.40
▸ ATR Q13535 1/20 0.39
▸ ATRIP Q8WXE1 1/20 0.39
▸ PSEN1 P49768 3/20 0.39
▸ PSEN2 P49810 3/20 0.39
▸ APH1B Q8WW43 3/20 0.39
▸ NCSTN Q92542 3/20 0.39
▸ APH1A Q96BI3 3/20 0.39
▸ PSENEN Q9NZ42 3/20 0.39
▸ SUV39H2 Q9H5I1 1/20 0.39
▸ APP P05067 1/20 0.39
▸ CKS1B P61024 1/20 0.37
▸ SKP1 P63208 1/20 0.37
▸ SKP2 Q13309 1/20 0.37
▸ CNR1 P21554 1/20 0.37
▸ CNR2 P34972 1/20 0.37

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
SCHEMBL18952685 1.00 GPR119 (0.41) GPR119JAK3BTKRETMAP4K4
SCHEMBL18971235 1.00 GPR119 (0.41) GPR119JAK3BTKRETMAP4K4
SCHEMBL23881623 1.00 GPR119 (0.41) GPR119JAK3BTKRETMAP4K4
SCHEMBL23881624 1.00 GPR119 (0.41) GPR119JAK3BTKRETMAP4K4
SCHEMBL30540111 0.89 PSEN1 (0.41) GPR119JAK3BTKRETMAP4K4
SCHEMBL21050357 0.89 PSEN1 (0.41) GPR119JAK3BTKRETMAP4K4
SCHEMBL21050356 0.89 PSEN1 (0.41) GPR119JAK3BTKRETMAP4K4
SCHEMBL20609200 0.89 PSEN1 (0.41) GPR119JAK3BTKRETMAP4K4
SCHEMBL18970962 0.89 PSEN1 (0.41) GPR119JAK3BTKRETMAP4K4
SCHEMBL21050358 0.89 PSEN1 (0.41) GPR119JAK3BTKRETMAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11319314-B2 Phenoxytriazoles HOFFMANN-LA ROCHE INC. (US) 2022-05-03 — — US disclosed
US-11319314-B2 Phenoxytriazoles HOFFMANN-LA ROCHE INC. (US) 2022-05-03 — — US disclosed
EP-3535266-B1 BICYCLIC HETEROARYL DERIVATIVES HOFFMANN LA ROCHE (CH) 2021-12-29 — — EP disclosed
EP-3519418-B1 BRIDGED PIPERIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2021-12-08 — — EP disclosed
US-20210309653-A1 PHENOXYTRIAZOLES HOFFMANN-LA ROCHE INC. (US) 2021-10-07 — — US disclosed
US-20210309653-A1 PHENOXYTRIAZOLES HOFFMANN-LA ROCHE INC. (US) 2021-10-07 — — US disclosed
US-10941147-B2 Bicyclic heteroaryl derivatives HOFFMANN-LA ROCHE INC. (US) 2021-03-09 — — US disclosed
US-10899766-B2 Bridged piperidine derivatives HOFFMANN-LA ROCHE INC. (US) 2021-01-26 — — US disclosed
US-20200291034-A1 BRIDGED PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2020-09-17 — — US disclosed
US-10562903-B2 Bridged piperidine derivatives HOFFMANN-LA ROCHE INC. (US) 2020-02-18 — — US disclosed
US-20200031831-A1 BRIDGED PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2020-01-30 — — US disclosed
US-20190284191-A1 BICYCLIC HETEROARYL DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2019-09-19 — — US disclosed
EP-3519418-A1 BRIDGED PIPERIDINE DERIVATIVES H. Hoffnabb-La Roche Ag (CH) 2019-08-07 — — EP disclosed
WO-2018060300-A1 BRIDGED PIPERIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2018-04-05 — — WO disclosed
WO-2017097728-A1 BRIDGED PIPERIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2017-06-15 — — WO 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 (8 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-20210309653-A1 PHENOXYTRIAZOLES HTT, PSEN1, APP GPR119 1411/4885JAK3 4178/4885BTK 4680/4885
US-20200031831-A1 BRIDGED PIPERIDINE DERIVATIVES PSEN1, APP, PRNP GPR119 1530/4885JAK3 4441/4885BTK 4515/4885
US-20190284191-A1 BICYCLIC HETEROARYL DERIVATIVES HUWE1, APP, HTT GPR119 1887/4885JAK3 3917/4885BTK 4145/4885
US-10941147-B2 Bicyclic heteroaryl derivatives HUWE1, APP, HTT GPR119 1887/4885JAK3 3917/4885BTK 4145/4885
US-10899766-B2 Bridged piperidine derivatives PSEN1, APP, PRNP GPR119 1530/4885JAK3 4441/4885BTK 4515/4885
US-20200291034-A1 BRIDGED PIPERIDINE DERIVATIVES PTGDR, HPGDS, PSEN1 GPR119 970/4885JAK3 4251/4885BTK 4648/4885
US-10562903-B2 Bridged piperidine derivatives PTGDR, HPGDS, PSEN1 GPR119 970/4885JAK3 4251/4885BTK 4648/4885
US-11319314-B2 Phenoxytriazoles HTT, APP, PSEN1 GPR119 1033/4885JAK3 3982/4885BTK 4604/4885

“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.

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