SCHEMBL20239189

SCHEMBL20239189

N#Cc1cc(Oc2ccc(CCNC(=O)O)cc2)nc(N)n1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.46
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.43
NPC1 O15118 1/20 0.43
OPRM1 P35372 3/20 0.40
EPHX2 P34913 1/20 0.40
ACACB O00763 1/20 0.39
PLAAT3 P53816 2/20 0.39
PLAAT5 Q96KN8 2/20 0.39
PLAAT2 Q9NWW9 2/20 0.39
PLAAT4 Q9UL19 2/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL20239138 0.87 EPHX2 (0.43) ALDH1A1SMN1; SMN2OPRM1EPHX2ACACB
SCHEMBL20259076 0.85 RAB9A (0.47) RAB9AALDH1A1SMN1; SMN2NPC1POLB
SCHEMBL20239237 0.85 ALDH1A1 (0.65) RAB9AALDH1A1SMN1; SMN2NPC1OPRM1
SCHEMBL20239168 0.83 RAB9A (0.47) RAB9AALDH1A1SMN1; SMN2NPC1OPRM1
SCHEMBL20239135 0.81 ACACB (0.45) SMN1; SMN2OPRM1EPHX2ACACBPLAAT3
SCHEMBL20239326 0.79 ALDH1A1 (0.43) RAB9AALDH1A1SMN1; SMN2OPRM1EPHX2
SCHEMBL20239293 0.76 SMN1; SMN2 (0.52) ALDH1A1SMN1; SMN2ACACBPLAAT3PLAAT5
SCHEMBL20239266 0.76 FFAR1 (0.52) OPRM1ACACBPLAAT3PLAAT5PLAAT2
SCHEMBL20259130 0.75 GLA (0.42) SMN1; SMN2POLBMAPTKMT2AGLA
SCHEMBL20239236 0.75 POLB (0.49) SMN1; SMN2OPRM1POLBMAPTKMT2A

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 2 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-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 (1 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 RAB9A 1170/4885ALDH1A1 1430/4885SMN1; SMN2 4828/4885

“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.