SCHEMBL20239307

SCHEMBL20239307

Cc1nc(CNc2ncc(Cl)cn2)cc(Oc2ccc(CCNS(N)(=O)=O)cc2)n1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DGAT2 Q96PD7 1/20 0.55
CA1 P00915 7/20 0.43
CA2 P00918 7/20 0.43
CA9 Q16790 7/20 0.43
CA12 O43570 5/20 0.43
CA14 Q9ULX7 4/20 0.43
CA5A P35218 2/20 0.43
CYP3A4 P08684 2/20 0.39
ALDH1A1 P00352 2/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.34
MRGPRX1 Q96LB2 1/20 0.33
PDE4B Q07343 1/20 0.33
PTGES2 Q9H7Z7 1/20 0.33
VNN1 O95497 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32

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
SCHEMBL20239180 0.90 DGAT2 (0.50) DGAT2CA1CA2CA9CA12
SCHEMBL20239255 0.90 DGAT2 (0.53) DGAT2CA1CA2CA9CA12
SCHEMBL16746061 0.87 DGAT2 (0.70) DGAT2CA1CA2CA9CYP3A4
SCHEMBL20239305 0.86 DGAT2 (0.49) DGAT2CA1CA2CA9CA12
SCHEMBL20472853 0.85 DGAT2 (0.53) DGAT2CYP3A4ALDH1A1RAB9ASMN1; SMN2
SCHEMBL18249813 0.85 DGAT2 (0.51) DGAT2CYP3A4ALDH1A1RAB9ASMN1; SMN2
SCHEMBL20239244 0.85 DGAT2 (0.48) DGAT2CYP3A4ALDH1A1RAB9AVNN1
SCHEMBL20239232 0.84 DGAT2 (0.46) DGAT2CYP3A4SMN1; SMN2PDE4B
SCHEMBL20259192 0.84 DGAT2 (0.47) DGAT2CYP3A4ALDH1A1SMN1; SMN2HDAC3
SCHEMBL20239226 0.84 DGAT2 (0.53) DGAT2CA1CA2CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 DGAT2 1/4885CA1 4849/4885CA2 4773/4885
US-10053429-B2 DGAT2 inhibitors DGAT2, DGAT1, LCAT DGAT2 1/4885CA1 4830/4885CA2 4742/4885

“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.