SCHEMBL825949

SCHEMBL825949

CC1(NC(=O)c2cc(F)c(F)c(F)c2F)C(=O)NC(=O)N(C2CCCCC2)C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 2/20 0.42
THRB P10828 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.36
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 6/20 0.34
ATM Q13315 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
HSD17B10 Q99714 2/20 0.32
PGR P06401 2/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
STAT3 P40763 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL825892 0.85 CRBN (0.40) CRBNTHRBSMN1; SMN2MAPK1L3MBTL1
SCHEMBL10046427 0.79 CRBN (0.40) CRBNSMN1; SMN2TDP1
SCHEMBL825867 0.79 CRBN (0.40) CRBNSMN1; SMN2ALDH1A1TDP1HSD17B10
SCHEMBL14402369 0.78 CRBN (0.39) CRBNSMN1; SMN2TDP1
SCHEMBL825863 0.78 CRBN (0.39) CRBNSMN1; SMN2TDP1
SCHEMBL825882 0.77 CRBN (0.38) CRBNSMN1; SMN2TDP1
SCHEMBL18155543 0.76 ALDH1A1 (0.37) CRBNSMN1; SMN2MAPK1ALDH1A1MEN1
SCHEMBL14402291 0.75 CRBN (0.44) CRBNSMN1; SMN2TDP1
SCHEMBL10046305 0.66 CRBN (0.39) CRBNSMN1; SMN2ATMTDP1
SCHEMBL825880 0.65 CRBN (0.38) CRBNSMN1; SMN2KMT2ATDP1

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 9 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
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-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-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
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
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
WO-2007120669-A1 TETRAHALOGENATED COMPOUNDS USEFUL AS INHIBITORS OF ANGIOGENESIS THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2007-10-25 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-20090186913-A1 Tetrahalogenated compounds useful as inhibitors of angiogenesis VHL, TEK, FLT4 CRBN 1015/4885THRB 385/4885SMN1; SMN2 3789/4885

“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.