SCHEMBL6477048

SCHEMBL6477048

C=CCCCN(N)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.41
TDP1 Q9NUW8 3/20 0.38
AOC3 Q16853 2/20 0.36
ESR1 P03372 1/20 0.34
LMNA P02545 1/20 0.33
ALDH1A1 P00352 2/20 0.33
USP2 O75604 1/20 0.33
HPGD P15428 1/20 0.33
KCNH2 Q12809 1/20 0.32
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
GAA P10253 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ADRA2C P18825 1/20 0.31
BCHE P06276 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
SCHEMBL22194163 0.82 KCNH2 (0.42) TLR8TDP1ALDH1A1USP2HPGD
SCHEMBL9717165 0.81 AOC3 (0.45) TDP1AOC3ALDH1A1KCNH2L3MBTL1
SCHEMBL10875552 0.77 PPARG (0.41) TLR8TDP1AOC3BCHE
SCHEMBL9717180 0.76 AOC3 (0.43) TDP1AOC3ALDH1A1MEN1KMT2A
SCHEMBL1444328 0.75 ESR1 (0.45) TDP1ESR1LMNAALDH1A1MEN1
SCHEMBL6486956 0.75 SOAT2 (0.42) TDP1ESR1LMNAALDH1A1USP2
SCHEMBL6486950 0.75 SOAT2 (0.42) TDP1ESR1LMNAALDH1A1USP2
SCHEMBL11254911 0.74 TDP1 (0.41) TLR8TDP1ALDH1A1USP2HPGD
SCHEMBL6488567 0.74 AOC3 (0.64) AOC3KCNH2
SCHEMBL449304 0.74 ESR1 (0.46) TDP1AOC3ESR1KCNH2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887863-B2 Hydrazide and alkoxyamide angiogenesis inhibitors ABBOTT LABORATORIES (US) 2005-05-03 US disclosed
EP-1272456-B1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LAB (US) 2004-10-27 EP disclosed
US-20040167126-A1 Hydrazide and alkoxyamide angiogenesis inhibitors ABBVIE INC. 2004-08-26 US disclosed
EP-1272456-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2003-01-08 EP disclosed
US-20020002152-A1 Hydrazide and alkoxyamide angiogenesis inhibitors ABBOTT LABORATORIES 2002-01-03 US disclosed
WO-2001079157-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2001-10-25 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 (2 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-20040167126-A1 Hydrazide and alkoxyamide angiogenesis inhibitors METAP2, METAP1, ANPEP TLR8 4441/4885TDP1 3859/4885AOC3 1365/4885
US-20020002152-A1 Hydrazide and alkoxyamide angiogenesis inhibitors METAP2, METAP1, ANPEP TLR8 4441/4885TDP1 3859/4885AOC3 1365/4885

“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.