SCHEMBL4247879

SCHEMBL4247879

COC(=O)CCNc1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.54
POLB P06746 2/20 0.50
ALDH1A1 P00352 3/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
GAA P10253 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
MAPT P10636 4/20 0.46
FFAR1 O14842 1/20 0.44
PKM P14618 1/20 0.44
RAB9A P51151 1/20 0.44
PTGS2 P35354 1/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43

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
SCHEMBL658049 0.85 MAPT (0.59) SMN1; SMN2POLBALDH1A1KMT2AMEN1
SCHEMBL31601639 0.84 SMN1; SMN2 (0.55) SMN1; SMN2POLBALDH1A1KMT2AMEN1
SCHEMBL13948407 0.84 MAPT (0.57) SMN1; SMN2POLBALDH1A1KMT2AMEN1
SCHEMBL5184390 0.84 SMN1; SMN2 (0.55) SMN1; SMN2POLBALDH1A1KMT2AMEN1
SCHEMBL28466046 0.83 MAPT (0.47) SMN1; SMN2POLBALDH1A1KMT2AMEN1
SCHEMBL16980499 0.83 SMN1; SMN2 (0.51) SMN1; SMN2POLBKMT2AMEN1GAA
SCHEMBL28470217 0.82 MAPT (0.66) SMN1; SMN2POLBALDH1A1KMT2AGAA
SCHEMBL4824629 0.82 SMN1; SMN2 (0.54) SMN1; SMN2POLBALDH1A1KMT2AGAA
SCHEMBL31033400 0.82 SMN1; SMN2 (0.54) SMN1; SMN2POLBALDH1A1KMT2AMEN1
SCHEMBL26251369 0.82 HPGD (0.63) SMN1; SMN2POLBALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111690695-A Enzymatic microfluidic online synthesis method of 3-phenylaminopropylhydroxamic acid 浙江工业大学 2020-09-22 CN disclosed
US-20130096334-A1 Magnetic Nanoparticle-Supported Glutathione as a Sustainable Organocatalyst The United States of America as represented by the Administrator of the United States Environment Pr (US) 2013-04-18 US disclosed
US-20130096334-A1 Magnetic Nanoparticle-Supported Glutathione as a Sustainable Organocatalyst The United States of America as represented by the Administrator of the United States Environment Pr (US) 2013-04-18 US disclosed
US-8324125-B2 Magnetic nanoparticle-supported glutathione as a sustainable organocatalyst THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE U.S. ENVIRONMENTAL PROTECTION AGENCY (US) 2012-12-04 US disclosed
US-8324125-B2 Magnetic nanoparticle-supported glutathione as a sustainable organocatalyst THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE U.S. ENVIRONMENTAL PROTECTION AGENCY (US) 2012-12-04 US disclosed
US-20110054180-A1 Magnetic Nanoparticle-Supported Glutathione as a Sustainable Organocatalyst USA as Represented by the Administrator of U.S. Environmental Protection Agency (US) 2011-03-03 US disclosed
US-20110054180-A1 Magnetic Nanoparticle-Supported Glutathione as a Sustainable Organocatalyst USA as Represented by the Administrator of U.S. Environmental Protection Agency (US) 2011-03-03 US disclosed
WO-2009127815-A1 AMINOALYL-IMIDAZOTETRAZINES FOR TREATMENT OF CANCER THE UNIVERSITY OF BRADFORD (GB) 2009-10-22 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 (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-20110054180-A1 Magnetic Nanoparticle-Supported Glutathione as a Sustainable Organocatalyst GSTK1, GSTA1, GSTP1 SMN1; SMN2 4528/4885POLB 3547/4885ALDH1A1 281/4885

“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.