SCHEMBL366573

SCHEMBL366573

C[N+]1(CCOP=O)CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.55
APOBEC3A P31941 3/20 0.42
APOBEC3G Q9HC16 3/20 0.42
LMNA P02545 2/20 0.42
CHRNB2 P17787 3/20 0.40
CHRNB4 P30926 3/20 0.40
CHRNA3 P32297 3/20 0.40
CHRNA7 P36544 3/20 0.40
CHRNA4 P43681 3/20 0.40
CHRNA10 Q9GZZ6 3/20 0.40
CHRNA9 Q9UGM1 3/20 0.40
KMT2A Q03164 2/20 0.39
BBOX1 O75936 2/20 0.38
CDC25A P30304 1/20 0.38
HTT P42858 3/20 0.37
PKM P14618 1/20 0.36
CTDSP1 Q9GZU7 2/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL372822 0.73 KDM4E (0.95) KDM4EAPOBEC3AAPOBEC3GLMNACHRNB2
SCHEMBL718386 0.73 KDM4E (0.95) KDM4EAPOBEC3AAPOBEC3GLMNACHRNB2
SCHEMBL5944464 0.72 KDM4E (0.57) KDM4EAPOBEC3AAPOBEC3GLMNACHRNB2
SCHEMBL16674108 0.72 KDM4E (0.62) KDM4EAPOBEC3AAPOBEC3GLMNACHRNB2
SCHEMBL23050168 0.72 KDM4E (0.47) KDM4EAPOBEC3AAPOBEC3GLMNACHRNB2
SCHEMBL19812383 0.72 KDM4E (0.57) KDM4EAPOBEC3AAPOBEC3GLMNACHRNB2
Water SCHEMBL15375367 0.71 KDM4E (0.91) KDM4EAPOBEC3AAPOBEC3GLMNACHRNB2
Iodide SCHEMBL14877089 0.71 KDM4E (1.00) KDM4EAPOBEC3AAPOBEC3GLMNACHRNB2
Iodide SCHEMBL720052 0.71 KDM4E (1.00) KDM4EAPOBEC3AAPOBEC3GLMNACHRNB2
SCHEMBL23484981 0.71 KDM4E (0.61) KDM4EAPOBEC3AAPOBEC3GLMNACHRNB2

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-8097752-B2 Antiprotozoal ring-substituted phospholipids MAKSCIENTIFIC, LLC (US) 2012-01-17 US disclosed
US-20060105998-A1 Antiprotozoal ring-substiuted phospholipids MAK SCIENTIFIC CORPORATION (US) 2006-05-18 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-20060105998-A1 Antiprotozoal ring-substiuted phospholipids PHOSPHO1, PLTP, PLA2G2C KDM4E 3491/4885APOBEC3A 3220/4885APOBEC3G 3357/4885

“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.