SCHEMBL20239191

SCHEMBL20239191

NCCc1ccc(Oc2cc(CNc3ncc(Cl)cn3)ccn2)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 8/20 0.44
LOX P28300 5/20 0.43
MAOB P27338 3/20 0.40
DGAT2 Q96PD7 1/20 0.40
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
VNN1 O95497 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36

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
SCHEMBL18249755 0.87 LOXL2 (0.43) LOXL2LOXTAAR1
SCHEMBL20239188 0.83 DGAT2 (0.40) LOXL2LOXDGAT2VNN1
SCHEMBL18249766 0.83 PLAAT3 (0.44) LOXL2LOXHDAC3HDAC1HDAC2
SCHEMBL20259122 0.83 DGAT2 (0.45) MAOBDGAT2VNN1TAAR1
Hydrochloric Acid SCHEMBL21924528 0.82 LOXL2 (0.40) LOXL2LOXDGAT2VNN1
Hydrochloric Acid SCHEMBL21924527 0.82 LOXL2 (0.40) LOXL2LOXDGAT2VNN1
SCHEMBL20239265 0.82 DGAT2 (0.42) LOXL2LOXDGAT2HDAC3HDAC1
SCHEMBL20239243 0.82 DGAT2 (0.42) LOXL2LOXDGAT2HDAC3HDAC1
SCHEMBL28655990 0.80 LOXL2 (0.55) LOXL2LOXMAOBTAAR1
SCHEMBL20259233 0.80 LOX (0.45) LOXL2LOXVNN1

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 2453/4885MAOB 2352/4885
US-10053429-B2 DGAT2 inhibitors DGAT2, DGAT1, LCAT LOXL2 1951/4885LOX 2250/4885MAOB 1857/4885

“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.