SCHEMBL828185

SCHEMBL828185

CCC1(N)C(=O)NC(=O)N(C(C)C)C1=O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
KDM4E B2RXH2 1/20 0.30
CYP3A4 P08684 1/20 0.30
GABRB3 P28472 1/20 0.30
OPRD1 P41143 1/20 0.30
GABRA2 P47869 1/20 0.30
GABRB2 P47870 1/20 0.30

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 SCHEMBL829889 0.73 MAPT (0.34) ALDH1A1MAPT
Hydrochloric Acid SCHEMBL829408 0.72 SMN1; SMN2 (0.37) ALDH1A1MAPT
SCHEMBL10281706 0.69 CYP3A4 (0.60) ALDH1A1MAPTKDM4ECYP3A4GABRB3
Hydrochloric Acid SCHEMBL829746 0.69 SMN1; SMN2 (0.41) ALDH1A1MAPTKDM4E
SCHEMBL17791220 0.67 LMNA (0.66) MAPT
SCHEMBL11677957 0.67 LMNA (0.47) ALDH1A1KDM4ECYP3A4GABRB3OPRD1
SCHEMBL828772 0.66 ELANE (0.53) ALDH1A1MAPTKDM4E
SCHEMBL16200785 0.65 FPR2 (0.37) ALDH1A1KDM4ECYP3A4GABRB3OPRD1
SCHEMBL19670119 0.64 CNR1 (0.31)
SCHEMBL6890760 0.62 MMP9 (0.36) ALDH1A1MAPTCYP3A4

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-2004614-B1 TETRAHALOGENATED COMPOUNDS USEFUL AS INHIBITORS OF ANGIOGENESIS US GOV HEALTH & HUMAN SERV (US) 2016-10-19 EP disclosed
US-8143252-B2 Tetrahalogenated compounds useful as inhibitors of angiogenesis THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2012-03-27 US disclosed
US-20090186913-A1 Tetrahalogenated compounds useful as inhibitors of angiogenesis THE GOVERNMENT OF THE UNITED STATES OF AMERICA DEPARTMENT OF HEALTH AND HUMAN SERVICES 2009-07-23 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 (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-20090186913-A1 Tetrahalogenated compounds useful as inhibitors of angiogenesis VHL, TEK, FLT4 ALDH1A1 679/4885MAPT 2918/4885KDM4E 3741/4885

“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.