SCHEMBL20239235

SCHEMBL20239235

Nc1nc(CNC(=O)O)cc(Oc2ccc(CS(N)(=O)=O)cc2)n1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DGAT2 Q96PD7 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
PPARG P37231 6/20 0.36
NUDT1 P36639 1/20 0.36
LMNA P02545 1/20 0.35
GLA P06280 1/20 0.35
AKR1C3 P42330 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
ATM Q13315 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
F2 P00734 2/20 0.34

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
SCHEMBL20239312 0.86 DGAT2 (0.47) DGAT2SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL20239264 0.86 DGAT2 (0.45) DGAT2SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL20259075 0.86 DGAT2 (0.43) DGAT2SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL20239327 0.85 DGAT2 (0.44) DGAT2SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL20239318 0.85 LMNA (0.45) DGAT2SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL20239207 0.82 SMN1; SMN2 (0.48) DGAT2SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL20239204 0.79 DGAT2 (0.69) DGAT2SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL20239337 0.78 DGAT2 (0.58) DGAT2SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL20239168 0.75 RAB9A (0.47) SMN1; SMN2RAB9ANPC1ALDH1A1MEN1
SCHEMBL20259162 0.74 DGAT2 (0.42) DGAT2

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 1/4885SMN1; SMN2 4828/4885RAB9A 1170/4885
US-10053429-B2 DGAT2 inhibitors DGAT2, DGAT1, LCAT DGAT2 1/4885SMN1; SMN2 4835/4885RAB9A 1119/4885

“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.