SCHEMBL337522

SCHEMBL337522

CC(C)N(CCOP(C)(O)=S)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ESR1 P03372 2/20 0.33
ESR2 Q92731 2/20 0.33
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
LTA4H P09960 1/20 0.31

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
SCHEMBL28259637 0.86 LPAR3 (0.37) MEN1KMT2A
SCHEMBL28666575 0.85 LPAR3 (0.42) MEN1KMT2AESR1ESR2CHRM2
Phosphoric Acid SCHEMBL28675446 0.80 LPAR3 (0.38) MEN1KMT2AESR1ESR2CHRM2
SCHEMBL27256342 0.77 LPAR3 (0.42) MEN1KMT2AESR1ESR2CHRM2
SCHEMBL175957 0.76 MEN1 (0.32) MEN1KMT2A
SCHEMBL2784094 0.76 MEN1 (0.32) MEN1KMT2A
SCHEMBL2483954 0.76 CA12 (0.40) CHRM2CHRM1CHRM3CHRNB2CHRNA4
SCHEMBL1075365 0.76 CA12 (0.40) CHRM2CHRM1CHRM3CHRNB2CHRNA4
SCHEMBL28992249 0.73 CHRM2 (0.34) MEN1KMT2AESR1ESR2CHRM2
SCHEMBL4454861 0.71 MEN1 (0.34) MEN1KMT2AESR1ESR2CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108970543-B Method for inhibiting corrosion and method for oxidizing feed 通用原子公司 2021-11-23 CN disclosed
US-10688464-B2 Corrosion inhibition in hydrothermal processing GENERAL ATOMICS (US) 2020-06-23 US disclosed
US-20180345241-A1 CORROSION INHIBITION IN HYDROTHERMAL PROCESSING BANK OF THE WEST 2018-12-06 US disclosed
US-8097343-B2 Functionalized dendritic polymers for the capture and neutralization of biological and chemical agents TRITON SYSTEMS, INC. (US) 2012-01-17 US disclosed
EP-2035032-A2 METHODS FOR ESTER DETOXICATION Human Biomolecular Research Institute (US) 2009-03-18 EP disclosed
US-7384626-B2 Functionalized dendritic polymers for the capture and neutralization of biological and chemical agents TRITON SYSTEMS, INC. (US) 2008-06-10 US disclosed
WO-2007146003-A2 METHODS FOR ESTER DETOXICATION HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2007-12-21 WO disclosed
WO-2007146003-A2 METHODS FOR ESTER DETOXICATION HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2007-12-21 WO disclosed
US-20070286846-A1 Novel methods for ester detoxication HUMAN BIOMOLECULAR RESEARCH INSTITUTE 2007-12-13 US disclosed
US-20070286846-A1 Novel methods for ester detoxication HUMAN BIOMOLECULAR RESEARCH INSTITUTE 2007-12-13 US disclosed
US-20070286846-A1 Novel methods for ester detoxication HUMAN BIOMOLECULAR RESEARCH INSTITUTE 2007-12-13 US disclosed
US-20070071713-A1 FUNCTIONALIZED DENDRITIC POLYMERS FOR THE CAPTURE AND NEUTRALIZATION OF BIOLOGICAL AND CHEMICAL AGENTS TRITON SYSTEMS, INC. 2007-03-29 US disclosed
US-20070014754-A1 Functionalized dendritic polymers for the capture and neutralization of biological and chemical agents TRITON SYSTEMS, INC. 2007-01-18 US disclosed
WO-2006135406-A2 FUNCTIONALIZED DENDRITIC POLYMERS FOR THE CAPTURE AND NEUTRALIZATION OF BIOLOGICAL AND CHEMICAL AGENTS TRITON SYSTEMS, INC. (US) 2006-12-21 WO 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 (2 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-20070071713-A1 FUNCTIONALIZED DENDRITIC POLYMERS FOR THE CAPTURE AND NEUTRALIZATION OF BIOLOGICAL AND CHEMICAL AGENTS CD47, CD209, HAVCR2 MEN1 2208/4885KMT2A 1665/4885ESR1 4579/4885
US-20070286846-A1 Novel methods for ester detoxication CES2, BCHE, ACHE MEN1 4804/4885KMT2A 2377/4885ESR1 853/4885

“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.