SCHEMBL659742

SCHEMBL659742

O=Cc1ccc(I)c(Br)c1F

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
ERN1 O75460 4/20 0.32
TRIM24 O15164 1/20 0.32
TRIM33 Q9UPN9 1/20 0.32
KCNJ1 P48048 1/20 0.32
MCL1 Q07820 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
SCHEMBL24034364 0.85 MCL1 (0.33) TDP1MEN1LMNATHRBBLM
SCHEMBL5094577 0.82 TDP1 (0.36) TDP1MEN1LMNATHRBBLM
SCHEMBL29654634 0.77 ERN1 (0.43) TDP1MEN1LMNATHRBBLM
SCHEMBL659120 0.77 ERN1 (0.43) TDP1MEN1LMNATHRBBLM
SCHEMBL22768246 0.77 ERN1 (0.35) ERN1MCL1
SCHEMBL1806887 0.75 TDP1 (0.47) TDP1MEN1LMNATHRBBLM
SCHEMBL31306389 0.75 TDP1 (0.47) TDP1MEN1LMNATHRBBLM
SCHEMBL31306390 0.75 TDP1 (0.47) TDP1MEN1LMNATHRBBLM
SCHEMBL15195884 0.74 ERN1 (0.50) MEN1KMT2AERN1TRIM24TRIM33
SCHEMBL10989431 0.74 TDP1 (0.43) TDP1MEN1LMNATHRBBLM

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-8378104-B2 7-aminofuropyridine derivatives OSI Pharmaceuticals, LLC (US) 2013-02-19 US disclosed
EP-2534156-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI Pharmaceuticals, LLC (US) 2012-12-19 EP disclosed
US-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI PHARMACEUTICALS, INC. 2012-02-23 US disclosed
WO-2011100502-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI Pharmaceuticals, LLC (US) 2011-08-18 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-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES MAP3K5, STK17A, MAPKAPK5 TDP1 1024/4885MEN1 296/4885LMNA 3566/4885

“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.