SCHEMBL4168928

SCHEMBL4168928

CCOC(OCC)c1ncc(C(=O)NCc2ccccn2)c(C)n1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
HPGD P15428 8/20 0.48
HSD17B10 Q99714 5/20 0.48
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 4/20 0.48
GAA P10253 2/20 0.48
GLA P06280 1/20 0.48
RAB9A P51151 3/20 0.48
LMNA P02545 2/20 0.46
HTT P42858 1/20 0.46
ADORA2A P29274 1/20 0.46
ADORA1 P30542 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALOX15 P16050 1/20 0.45
NPC1 O15118 1/20 0.44

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
SCHEMBL4184603 0.74 ALOX15 (0.56) L3MBTL1HPGDHSD17B10ALDH1A1KDM4E
SCHEMBL4184600 0.74 ALOX15 (0.56) L3MBTL1HPGDHSD17B10ALDH1A1KDM4E
SCHEMBL4179985 0.74 RAB9A (0.50) L3MBTL1ALDH1A1KDM4EGAARAB9A
SCHEMBL4176051 0.74 HPGD (0.46) HPGDHSD17B10ALDH1A1KDM4EGAA
SCHEMBL27725520 0.73 L3MBTL1 (0.60) L3MBTL1HPGDHSD17B10ALDH1A1KDM4E
SCHEMBL4176813 0.72 RAB9A (0.38) L3MBTL1HPGDALDH1A1KDM4ERAB9A
SCHEMBL5321616 0.71 HPGD (0.69) L3MBTL1HPGDHSD17B10ALDH1A1KDM4E
SCHEMBL249932 0.71 HPGD (0.58) L3MBTL1HPGDHSD17B10ALDH1A1KDM4E
SCHEMBL22861337 0.70 SMN1; SMN2 (0.63) L3MBTL1HPGDHSD17B10ALDH1A1GAA
SCHEMBL12024781 0.68 LMNA (0.62) L3MBTL1HPGDHSD17B10ALDH1A1KDM4E

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
US-20090143410-A1 Isoxazolines for Controlling Invertebrate Pests E. I. DU PONT DE NEMOURS AND COMPANY 2009-06-04 US disclosed
CN-101330828-A Isoxazolines for controlling invertebrate pests DU PONT (US) 2008-12-24 CN 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-20090143410-A1 Isoxazolines for Controlling Invertebrate Pests CBR3, RTN3, HCN3 L3MBTL1 727/4885HPGD 4021/4885HSD17B10 2236/4885

“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.