SCHEMBL20239149

SCHEMBL20239149

CCc1cnc(NCc2ccnc(Oc3ccc(CCNC(=O)[C@@H](C)O)cc3)c2)nc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 4/20 0.40
LOX P28300 3/20 0.40
PLAAT3 P53816 2/20 0.38
PLAAT5 Q96KN8 2/20 0.38
PLAAT2 Q9NWW9 2/20 0.38
PLAAT4 Q9UL19 2/20 0.38
OPRM1 P35372 2/20 0.37
OPRD1 P41143 2/20 0.37
OPRK1 P41145 1/20 0.37
ADORA2A P29274 1/20 0.37
ADORA2B P29275 1/20 0.37
ALDH1A1 P00352 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ACACB O00763 4/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
VNN1 O95497 1/20 0.35

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
SCHEMBL20239240 1.00 LOXL2 (0.40) LOXL2LOXPLAAT3PLAAT5PLAAT2
SCHEMBL20239150 1.00 LOXL2 (0.40) LOXL2LOXPLAAT3PLAAT5PLAAT2
SCHEMBL20259231 0.88 ACACB (0.45) LOXL2LOXPLAAT3PLAAT5PLAAT2
SCHEMBL20259236 0.87 LOXL2 (0.41) LOXL2LOXPLAAT3PLAAT5PLAAT2
SCHEMBL18249755 0.80 LOXL2 (0.43) LOXL2LOXSMN1; SMN2
SCHEMBL18249766 0.78 PLAAT3 (0.44) LOXL2LOXPLAAT3PLAAT5PLAAT2
SCHEMBL20259233 0.77 LOX (0.45) LOXL2LOXPLAAT3PLAAT5PLAAT2
SCHEMBL20239230 0.75 DGAT2 (0.47) LOXL2LOXSMN1; SMN2VNN1
SCHEMBL20239301 0.75 LMNA (0.41) LOXL2LOXPLAAT3PLAAT5PLAAT2
SCHEMBL20239198 0.75 DGAT2 (0.37) LOXL2LOXALDH1A1SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107635975-B DGAT2 inhibitors 伊莱利利公司 2020-07-24 CN disclosed
EP-3298001-B1 DGAT2 INHIBITORS LILLY CO ELI (US) 2020-05-13 EP disclosed
US-10053429-B2 DGAT2 inhibitors ELI LILLY AND COMPANY (US) 2018-08-21 US disclosed
US-20180162825-A1 NOVEL DGAT2 INHIBITORS ELI LILY AND COMPANY (US) 2018-06-14 US disclosed
US-20180162825-A1 NOVEL DGAT2 INHIBITORS ELI LILY AND COMPANY (US) 2018-06-14 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 (2 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-20180162825-A1 NOVEL DGAT2 INHIBITORS DGAT2, DGAT1, LCAT LOXL2 2081/4885LOX 2453/4885PLAAT3 56/4885
US-10053429-B2 DGAT2 inhibitors DGAT2, DGAT1, LCAT LOXL2 1951/4885LOX 2250/4885PLAAT3 67/4885

“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.