SCHEMBL13161990

SCHEMBL13161990

Cc1cccnc1C(=O)NC1CCOCC1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.54
OPRL1 P41146 1/20 0.50
PDE4B Q07343 1/20 0.48
PDE4D Q08499 1/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
GRM4 Q14833 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
DYRK1A Q13627 2/20 0.46
DHODH Q02127 1/20 0.46
SMO Q99835 1/20 0.45
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
GABRA1 P14867 1/20 0.43
TRPV1 Q8NER1 1/20 0.43
MAPK1 P28482 1/20 0.43
ELANE P08246 1/20 0.43
ACKR3 P25106 1/20 0.42

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
SCHEMBL22449359 0.86 ALDH1A1 (0.64) GRM5KDM4EALDH1A1GAASMN1; SMN2
SCHEMBL14545078 0.83 GRM5 (0.54) GRM5KDM4EALDH1A1GAADYRK1A
SCHEMBL5232830 0.79 CNR1 (0.55) GRM4
SCHEMBL13162693 0.77 NPC1 (0.72) ALDH1A1GAASMN1; SMN2RAB9ANPC1
SCHEMBL30687934 0.76 DYRK1A (0.45) PDE4BPDE4DKDM4EALDH1A1GAA
SCHEMBL26856711 0.76 GRM4 (0.51) PDE4BPDE4DKDM4EALDH1A1GAA
SCHEMBL26856714 0.76 GRM4 (0.51) PDE4BPDE4DKDM4EALDH1A1GAA
SCHEMBL26856484 0.76 CNR1 (0.52) GRM4
SCHEMBL12469159 0.75 GRM5 (0.67) GRM5KDM4EGAAGRM4
SCHEMBL20477095 0.74 SMN1; SMN2 (0.57) KDM4EALDH1A1SMN1; SMN2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2206707-B1 AZOLECARBOXAMIDE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC (JP) 2014-07-23 EP disclosed
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed
US-20100249088-A1 AZOLECARBOXAMIDE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2010-09-30 US disclosed
EP-2206707-A1 AZOLECARBOXAMIDE COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2010-07-14 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-20100249088-A1 AZOLECARBOXAMIDE COMPOUND OR SALT THEREOF TRPV1, FGFR3, GPR17 GRM5 1220/4885OPRL1 110/4885PDE4B 1078/4885

“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.