SCHEMBL10190106

SCHEMBL10190106

CN(C)Cc1ccc(OC2CN(C(=O)OC(C)(C)C)C2)cc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.55
GPR119 Q8TDV5 6/20 0.53
MCHR1 Q99705 2/20 0.53
KCNH2 Q12809 1/20 0.53
JAK2 O60674 1/20 0.47
JAK1 P23458 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
ALDH1A1 P00352 1/20 0.41
CHEK2 O96017 1/20 0.41
PDE4B Q07343 1/20 0.40
TACR1 P25103 1/20 0.40

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
SCHEMBL25517604 0.86 GPR119 (0.50) USP30GPR119ALDH1A1CHEK2PDE4B
SCHEMBL321436 0.83 MCHR1 (0.57) USP30MCHR1KCNH2HRH3
SCHEMBL10190070 0.82 KCNH2 (0.56) USP30GPR119MCHR1KCNH2JAK2
SCHEMBL10190058 0.82 KCNH2 (0.57) USP30GPR119MCHR1KCNH2JAK2
SCHEMBL10190085 0.82 MCHR1 (0.57) USP30GPR119MCHR1KCNH2HRH3
SCHEMBL12788093 0.81 USP30 (0.53) USP30GPR119MCHR1ALDH1A1CHEK2
SCHEMBL28670992 0.81 USP30 (0.53) USP30GPR119ALDH1A1CHEK2
SCHEMBL6182215 0.81 USP30 (0.53) USP30GPR119ALDH1A1CHEK2
SCHEMBL321227 0.81 KCNH2 (0.54) USP30GPR119MCHR1KCNH2HRH3
SCHEMBL3343250 0.80 USP30 (0.52) USP30GPR119ALDH1A1CHEK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2590969-B1 Therapeutic agents 976 ASTRAZENECA AB (SE) 2014-10-15 EP disclosed
US-8546375-B2 (3-(4-(aminomethyl)phenoxy or phenylthio)azetidin-1-yl)(5-phenyl-1,3,4-oxadiazol-2-yl)methanone compounds ASTRAZENECA AB (SE) 2013-10-01 US disclosed
US-8546375-B2 (3-(4-(aminomethyl)phenoxy or phenylthio)azetidin-1-yl)(5-phenyl-1,3,4-oxadiazol-2-yl)methanone compounds ASTRAZENECA AB (SE) 2013-10-01 US disclosed
WO-2012004588-A2 THERAPEUTIC AGENTS 976 ASTRAZENECA AB (SE) 2012-01-12 WO disclosed
US-20120010189-A1 (3-(4-(AMINOMETHYL)PHENOXY OR PHENYLTHIO)AZETIDIN-1-YL)(5-PHENYL-1,3,4-OXADIAZOL-2-YL)METHANONE COMPOUNDS ASTRAZENECA AB (SE) 2012-01-12 US disclosed
US-20120010189-A1 (3-(4-(AMINOMETHYL)PHENOXY OR PHENYLTHIO)AZETIDIN-1-YL)(5-PHENYL-1,3,4-OXADIAZOL-2-YL)METHANONE COMPOUNDS ASTRAZENECA AB (SE) 2012-01-12 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-20120010189-A1 (3-(4-(AMINOMETHYL)PHENOXY OR PHENYLTHIO)AZETIDIN-1-YL)(5-PHENYL-1,3,4-OXADIAZOL-2-YL)METHANONE COMPOUNDS TYR, MC2R, MC1R USP30 2750/4885GPR119 581/4885MCHR1 9/4885

“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.