SCHEMBL15034040

SCHEMBL15034040

CCC[N+](C)(CCO)CCO

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
CYP3A4 P08684 1/20 0.45
SLC5A7 Q9GZV3 1/20 0.45
DNM1 Q05193 3/20 0.44
PSMD14 O00487 2/20 0.42
PLA2G1B P04054 2/20 0.42
MMP2 P08253 2/20 0.42
ATG4B Q9Y4P1 2/20 0.42
RAD52 P43351 1/20 0.42
SLC22A1 O15245 1/20 0.37
ALDH1A1 P00352 2/20 0.35
HSP90AA1 P07900 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.32
TSHR P16473 1/20 0.32

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
Hydrochloric Acid SCHEMBL28002637 0.97 CYP3A4 (0.50) LMNAMEN1KMT2ACYP3A4SLC5A7
Bromide SCHEMBL30645628 0.97 MEN1 (0.50) LMNAMEN1KMT2ACYP3A4SLC5A7
Formic Acid SCHEMBL11663826 0.89 PSMD14 (0.41) LMNAMEN1KMT2ACYP3A4SLC5A7
SCHEMBL159367 0.87 MEN1 (0.56) LMNAMEN1KMT2ACYP3A4SLC5A7
Formic Acid SCHEMBL11663824 0.85 PSMD14 (0.39) LMNAMEN1KMT2ACYP3A4SLC5A7
SCHEMBL14123849 0.83 DNM1 (0.34) LMNAMEN1KMT2ACYP3A4SLC5A7
SCHEMBL20201348 0.83 SMN1; SMN2 (0.39) LMNAMEN1KMT2ACYP3A4SLC5A7
Hydrochloric Acid SCHEMBL2444152 0.83 CYP3A4 (0.62) LMNAMEN1KMT2ACYP3A4SLC5A7
Water SCHEMBL490994 0.83 MEN1 (0.53) LMNAMEN1KMT2ACYP3A4SLC5A7
SCHEMBL10416316 0.83 MEN1 (0.53) LMNAMEN1KMT2ACYP3A4SLC5A7

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-11858961-B2 Solutions of quaternary and tertiary ammonium cation detergents to denature proteins, and kits for making them AGILENT TECHNOLOGIES, INC. (US) 2024-01-02 US disclosed
US-11111268-B2 Use of quaternary and tertiary ammonium cations to denature proteins AGILENT TECHNOLOGIES, INC. (US) 2021-09-07 US disclosed
CN-106398581-B Antistatic agent for adhesive 第一工业制药株式会社 2020-06-23 CN disclosed
US-20190169230-A1 Use of Quaternary and Tertiary Ammonium Cations to Denature Proteins PROZYME, INC. (US) 2019-06-06 US disclosed
US-20130156992-A1 ANTISTATIC POLYESTER RESIN MOLDED BODY CANON KABUSHIKI KAISHA (JP) 2013-06-20 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 (3 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-11111268-B2 Use of quaternary and tertiary ammonium cations to denature proteins PDIA3, STOM, PDIA6 LMNA 2506/4885MEN1 4729/4885KMT2A 4084/4885
US-20190169230-A1 Use of Quaternary and Tertiary Ammonium Cations to Denature Proteins PDIA3, STOM, PDIA6 LMNA 2506/4885MEN1 4729/4885KMT2A 4084/4885
US-11858961-B2 Solutions of quaternary and tertiary ammonium cation detergents to denature proteins, and kits for making them STOM, PDIA3, PDIA5 LMNA 2392/4885MEN1 4680/4885KMT2A 4227/4885

“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.