SCHEMBL5754355

SCHEMBL5754355

Fc1ccc(Nc2cccc(Br)c2)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.47
KDR P35968 1/20 0.47
SOS1 Q07889 1/20 0.46
APP P05067 1/20 0.45
EGFR P00533 1/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
HTT P42858 1/20 0.44
RAPGEF4 Q8WZA2 1/20 0.44
GAA P10253 2/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
TP53 P04637 1/20 0.42
HPGD P15428 1/20 0.42
ALOX12 P18054 1/20 0.42

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
SCHEMBL21468597 0.87 SOS1 (0.53) MAPK14SOS1APPSMN1; SMN2NPC1
SCHEMBL13042657 0.80 RAB9A (0.59) MAPK14SOS1EGFRSMN1; SMN2NPC1
SCHEMBL29980421 0.78 RAPGEF4 (0.49) KDREGFRRAPGEF4ALDH1A1LMNA
SCHEMBL12266353 0.78 RAPGEF4 (0.49) KDREGFRRAPGEF4ALDH1A1LMNA
SCHEMBL22864084 0.77 MAPK14 (0.59) MAPK14SMN1; SMN2NPC1RAB9ARAPGEF4
SCHEMBL28689644 0.77 LMNA (0.61) SMN1; SMN2NPC1RAB9AHTTGAA
Hydrochloric Acid SCHEMBL27087418 0.77 RAPGEF4 (0.47) KDREGFRRAPGEF4ALDH1A1LMNA
Hydrochloric Acid SCHEMBL29980355 0.77 RAPGEF4 (0.47) KDREGFRRAPGEF4ALDH1A1LMNA
SCHEMBL14137199 0.75 EGFR (0.57) EGFRRAPGEF4GAAALDH1A1LMNA
SCHEMBL1687027 0.74 RAPGEF4 (0.61) KDREGFRRAPGEF4GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1379234-B1 HALOGENATED AMINOBENZOPHENONES AND AMINOBENZOYLPYRIDINES AS INHIBITORS OF IL-1 AND TNF NOVARTIS AG (CH) 2006-03-29 EP disclosed
US-6919336-B2 Hallogenated aminobenzophenones and aminobenzoylpyridines as inhibitors of IL-1 and TNF NOVARTIS AG (CH) 2005-07-19 US disclosed
US-20040097731-A1 Hallogenated aminobenzophenones and aminobenzoylpyridines as inhibitors of il-1and tnf NOVARTIS AG (CH) 2004-05-20 US disclosed
EP-1379234-A1 HALOGENATED AMINOBENZOPHENONES AND AMINOBENZOYLPYRIDINES AS INHIBITORS OF IL-1 AND TNF Novartis AG (CH) 2004-01-14 EP disclosed
WO-2002076447-A1 HALLOGENATED AMINOBENZOPHENONES AND AMINOBENZOYLPYRIDINES AS INHIBITORS OF IL-1 AND TNF NOVARTIS AG (CH) 2002-10-03 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-20040097731-A1 Hallogenated aminobenzophenones and aminobenzoylpyridines as inhibitors of il-1and tnf TNF, NFKBIA, IL1A MAPK14 35/4885KDR 1399/4885SOS1 2216/4885

“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.