SCHEMBL20239271

SCHEMBL20239271

CCc1cnc(NCc2cc(Oc3ccc(CCN)cc3)nc(N)n2)nc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.49
RAB9A P51151 2/20 0.49
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 1/20 0.46
DGAT2 Q96PD7 1/20 0.41
TAAR1 Q96RJ0 1/20 0.35
RXRA P19793 2/20 0.35
GRIN1 Q05586 2/20 0.35
GRIN2B Q13224 2/20 0.35
PDE4B Q07343 1/20 0.35
NUDT1 P36639 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
DHFR P00374 1/20 0.33

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
SCHEMBL20259074 0.89 DGAT2 (0.41) SMN1; SMN2RAB9ANPC1ALDH1A1DGAT2
SCHEMBL20239216 0.88 DGAT2 (0.50) SMN1; SMN2RAB9ANPC1ALDH1A1DGAT2
SCHEMBL20239222 0.86 SMN1; SMN2 (0.46) SMN1; SMN2RAB9ANPC1ALDH1A1DGAT2
SCHEMBL20239173 0.85 SMN1; SMN2 (0.46) SMN1; SMN2RAB9ANPC1ALDH1A1DGAT2
SCHEMBL20239151 0.85 SMN1; SMN2 (0.45) SMN1; SMN2RAB9ANPC1ALDH1A1DGAT2
SCHEMBL20259121 0.85 SMN1; SMN2 (0.45) SMN1; SMN2RAB9ANPC1ALDH1A1DGAT2
SCHEMBL20239337 0.85 DGAT2 (0.58) SMN1; SMN2RAB9ANPC1ALDH1A1DGAT2
SCHEMBL20239338 0.83 SMN1; SMN2 (0.46) SMN1; SMN2RAB9ANPC1ALDH1A1DGAT2
SCHEMBL20259158 0.82 SMN1; SMN2 (0.44) SMN1; SMN2RAB9ANPC1ALDH1A1DGAT2
SCHEMBL18249755 0.79 LOXL2 (0.43) SMN1; SMN2RAB9ANPC1TAAR1

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 4 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
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 SMN1; SMN2 4828/4885RAB9A 1170/4885NPC1 33/4885
US-10053429-B2 DGAT2 inhibitors DGAT2, DGAT1, LCAT SMN1; SMN2 4835/4885RAB9A 1119/4885NPC1 32/4885

“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.