SCHEMBL5874286

SCHEMBL5874286

CC(C)(C)OC(=O)N1CCC(C)(c2ccccn2)C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.49
VNN1 O95497 1/20 0.48
CYP11B2 P19099 1/20 0.47
GRM5 P41594 2/20 0.46
POLB P06746 1/20 0.46
SCD5 Q86SK9 1/20 0.45
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
USP30 Q70CQ3 2/20 0.43
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
CYP3A4 P08684 2/20 0.43
CYP2D6 P10635 2/20 0.43
HSD17B10 Q99714 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HSD11B1 P28845 1/20 0.43
MAPK1 P28482 1/20 0.42
GRM1 Q13255 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL1181843 0.82 GPR119 (0.54) GPR119CYP11B2GRM5POLBOPRD1
SCHEMBL5874311 0.82 GPR119 (0.47) GPR119CYP11B2GRM5POLBSCD5
SCHEMBL29535693 0.82 GPR119 (0.51) GPR119GRM5POLBOPRD1OPRK1
SCHEMBL5472801 0.82 GPR119 (0.51) GPR119GRM5POLBOPRD1OPRK1
SCHEMBL2224318 0.81 GPR119 (0.53) GPR119CYP11B2GRM5POLBOPRD1
SCHEMBL6888743 0.81 GPR119 (0.53) GPR119CYP11B2GRM5POLBOPRD1
SCHEMBL5874046 0.81 JAK2 (0.47) GPR119CYP11B2GRM5POLBSCD5
SCHEMBL27099790 0.81 TSHR (0.52) GPR119CYP11B2SCD5OPRD1OPRK1
SCHEMBL23121066 0.81 GPR119 (0.45) GPR119CYP11B2GRM5POLBSCD5
SCHEMBL5874035 0.81 GPR119 (0.45) GPR119VNN1CYP11B2GRM5POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7012144-B2 Quinolone carboxylic acid derivatives KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2006-03-14 US disclosed
US-20030130302-A1 Quinolone carboxylic acid derivatives KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2003-07-10 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-20030130302-A1 Quinolone carboxylic acid derivatives CYCS, CBR3, HCCS GPR119 3350/4885VNN1 4365/4885CYP11B2 469/4885

“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.