SCHEMBL3548540

SCHEMBL3548540

COC(=O)C(=O)Nc1ccc(N2CCC(C(=O)OC)CC2)nc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.54
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
ALDH1A1 P00352 2/20 0.47
DGAT1 O75907 5/20 0.47
MAPT P10636 3/20 0.46
ADORA3 P0DMS8 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
LMNA P02545 1/20 0.45
RAB9A P51151 1/20 0.44
TSHR P16473 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43

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
SCHEMBL3541057 0.91 ALDH1A1 (0.47) KDM4EMEN1KMT2AALDH1A1DGAT1
SCHEMBL3543293 0.88 KDM4E (0.52) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL18248410 0.81 KDM4E (0.60) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL10174357 0.80 KDM4E (0.61) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL3549423 0.79 KDM4E (0.46) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL24312784 0.79 KDM4E (0.60) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL29592865 0.79 KDM4E (0.60) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL13009506 0.79 DGAT1 (0.51) KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL3541406 0.78 DGAT1 (0.57) KDM4EKMT2AALDH1A1DGAT1L3MBTL1
SCHEMBL13009559 0.78 DGAT1 (0.45) KDM4EMEN1KMT2AALDH1A1DGAT1

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
US-20100317653-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2010-12-16 US disclosed
US-7795283-B2 Oxadiazole derivative as DGAT inhibitors ASTRAZENECA AB (SE) 2010-09-14 US disclosed
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors ASTRAZENECA AB (SE) 2008-04-24 US disclosed
EP-1833806-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS AstraZeneca AB (SE) 2007-09-19 EP disclosed
WO-2006064189-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2006-06-22 WO 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-20100317653-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS DGAT1, DGAT2, GPR119 KDM4E 3511/4885MEN1 3064/4885KMT2A 1509/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 KDM4E 3382/4885MEN1 3095/4885KMT2A 1490/4885

“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.