SCHEMBL18784283

SCHEMBL18784283

CCCCC/C=C\C/C=C\CCCCCCCCOCCOS(=O)(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 3/20 0.39
LMNA P02545 1/20 0.39
PKM P14618 1/20 0.38
HPGD P15428 2/20 0.38
POLB P06746 1/20 0.38
MCOLN3 Q8TDD5 1/20 0.36

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
SCHEMBL18784286 1.00 KMT2A (0.39) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL8711023 0.85 KMT2A (0.50) KMT2AMEN1ALDH1A1PKMHPGD
SCHEMBL8711063 0.85 KMT2A (0.50) KMT2AMEN1ALDH1A1PKMHPGD
SCHEMBL8713770 0.85 KMT2A (0.50) KMT2AMEN1ALDH1A1PKMHPGD
SCHEMBL8711803 0.85 KMT2A (0.50) KMT2AMEN1ALDH1A1PKMHPGD
SCHEMBL10792789 0.85 KMT2A (0.50) KMT2AMEN1ALDH1A1PKMHPGD
SCHEMBL8716642 0.83 KMT2A (0.51) KMT2AMEN1ALDH1A1PKMHPGD
SCHEMBL21219270 0.81 MEN1 (0.42) KMT2AMEN1PKMHPGD
SCHEMBL21219288 0.81 TBXA2R (0.40) KMT2AMEN1ALDH1A1LMNA
SCHEMBL8710708 0.80 KMT2A (0.53) KMT2AMEN1ALDH1A1PKMHPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3162794-B1 ALKYL SUBSTITUTED AZETIDINES AS CATIONIC LIPID KYOWA KIRIN CO LTD (JP) 2020-09-16 EP disclosed
US-20170224619-A1 CATIONIC LIPID KYOWA HAKKO KIRIN CO., LTD. (JP) 2017-08-10 US disclosed
EP-3162794-A1 CATIONIC LIPID Kyowa Hakko Kirin Co., Ltd. (JP) 2017-05-03 EP 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-20170224619-A1 CATIONIC LIPID NPC1L1, NPC1, SGMS1 KMT2A 2198/4885MEN1 475/4885ALDH1A1 3134/4885

“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.