SCHEMBL8607828

SCHEMBL8607828

CCCCCN(C(N)=O)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
ADH1A P07327 3/20 0.40
NAAA Q02083 2/20 0.39
ADH1C P00326 2/20 0.39
ADH4 P08319 1/20 0.39
EPHX1 P07099 9/20 0.38
EPHX2 P34913 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37

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
SCHEMBL6255211 0.98 THRA (0.42) THRATHRBADH1ANAAAADH1C
SCHEMBL9071877 0.95 L3MBTL1 (0.41) THRATHRBADH1ANAAAADH1C
Hydrochloric Acid SCHEMBL27363306 0.89 ADH1C (0.44) ADH1ANAAAADH1CADH4L3MBTL1
SCHEMBL27971919 0.87 ADH1A (0.47) ADH1AADH1CL3MBTL1
Hydrochloric Acid SCHEMBL27529969 0.86 ADH1A (0.46) ADH1AADH1CL3MBTL1
Hydrochloric Acid SCHEMBL27321586 0.84 ADH1A (0.44) ADH1AADH1CL3MBTL1
Hydrochloric Acid SCHEMBL27341644 0.84 L3MBTL1 (0.43) ADH1AADH1CADH4L3MBTL1
SCHEMBL5146008 0.83 NAAA (0.40) ADH1ANAAAADH1CADH4EPHX1
SCHEMBL7715306 0.83 NAAA (0.40) ADH1ANAAAADH1CADH4EPHX1
SCHEMBL22023395 0.83 NAAA (0.46) THRATHRBADH1ANAAAADH1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160318856-A1 Substituted Urea eIF2alpha Kinase Activators NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-11-03 US disclosed
WO-2015038778-A1 SUBSTITUTED UREA EIF2α KINASE ACTIVATORS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2015-03-19 WO disclosed
US-5767113-A Compounds useful for concurrently activating glucocorticoid-induced response and reducing multidrug resistance THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1998-06-16 US disclosed
WO-1996035426-A1 COMPOUNDS USEFUL FOR CONCURRENTLY ACTIVATING GLUCOCORTICOID-INDUCED RESPONSE AND REDUCING MULTIDRUG RESISTANCE THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1996-11-14 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-20160318856-A1 Substituted Urea eIF2alpha Kinase Activators EIF2AK1, EIF2A, EIF4A2 THRA 2559/4885THRB 2692/4885ADH1A 4276/4885

“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.