SCHEMBL4184600

SCHEMBL4184600

Cc1nc(/C=N\O)ncc1C(=O)NCc1ccccn1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.52
HPGD P15428 7/20 0.50
KDM4E B2RXH2 6/20 0.50
ALDH1A1 P00352 5/20 0.50
HSD17B10 Q99714 4/20 0.50
RAB9A P51151 2/20 0.50
GLA P06280 1/20 0.50
GAA P10253 1/20 0.50
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 1/20 0.46
PTPN11 Q06124 1/20 0.45

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 1.00 ALOX15 (0.56) ALOX15L3MBTL1HPGDKDM4EALDH1A1
SCHEMBL2458673 0.77 ALOX15 (0.58) ALOX15L3MBTL1HPGDKDM4EALDH1A1
SCHEMBL740055 0.77 ALOX15 (0.58) ALOX15L3MBTL1HPGDKDM4EALDH1A1
SCHEMBL27725520 0.75 L3MBTL1 (0.60) L3MBTL1HPGDKDM4EALDH1A1HSD17B10
SCHEMBL4168928 0.74 L3MBTL1 (0.50) ALOX15L3MBTL1HPGDKDM4EALDH1A1
SCHEMBL5321616 0.73 HPGD (0.69) L3MBTL1HPGDKDM4EALDH1A1HSD17B10
SCHEMBL249932 0.72 HPGD (0.58) L3MBTL1HPGDKDM4EALDH1A1HSD17B10
SCHEMBL12024781 0.70 LMNA (0.62) L3MBTL1HPGDKDM4EALDH1A1HSD17B10
SCHEMBL27680048 0.70 HPGD (0.64) L3MBTL1HPGDKDM4EALDH1A1HSD17B10
SCHEMBL13534520 0.70 HPGD (0.63) L3MBTL1HPGDKDM4EALDH1A1HSD17B10

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 1 patent. 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

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 ALOX15 1284/4885L3MBTL1 727/4885HPGD 4021/4885

“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.