SCHEMBL3426313

SCHEMBL3426313

O=Cc1cccc(OBOc2cccc(C=O)c2C=O)c1C=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ERN1 O75460 3/20 0.43
TLR2 O60603 1/20 0.43
TLR1 Q15399 1/20 0.43
TLR6 Q9Y2C9 1/20 0.43
LMNA P02545 3/20 0.41
KMT2A Q03164 3/20 0.41
GAA P10253 1/20 0.41
MEN1 O00255 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
THRB P10828 1/20 0.41
BLM P54132 1/20 0.41
SRC P12931 2/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL841267 0.81 ALDH1A1 (0.59) ALDH1A1HPGDHTTSMN1; SMN2ERN1
SCHEMBL28886230 0.81 ALDH1A1 (0.48) ALDH1A1HPGDHTTSMN1; SMN2ERN1
SCHEMBL5070862 0.81 LMNA (0.50) ALDH1A1HPGDHTTSMN1; SMN2ERN1
SCHEMBL1785881 0.78 ALDH1A1 (0.42) ALDH1A1HPGDHTTSMN1; SMN2ERN1
SCHEMBL1028678 0.78 ERN1 (0.63) ALDH1A1HPGDHTTSMN1; SMN2ERN1
SCHEMBL2277795 0.76 CA1 (0.56) ALDH1A1HPGDHTTSMN1; SMN2ERN1
SCHEMBL547829 0.75 KMT2A (0.61) ALDH1A1HPGDHTTSMN1; SMN2ERN1
SCHEMBL31083348 0.74 ERN1 (0.46) ALDH1A1HPGDHTTSMN1; SMN2ERN1
SCHEMBL17884545 0.73 ALDH1A1 (0.50) ALDH1A1HPGDHTTSMN1; SMN2ERN1
SCHEMBL6667873 0.73 LMNA (0.72) ALDH1A1HPGDHTTSMN1; SMN2ERN1

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-1753743-B1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS SANOFI AVENTIS DEUTSCHLAND (DE) 2015-03-04 EP disclosed
US-7709466-B2 Pyridazinone derivatives, methods for their production and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-05-04 US disclosed
US-20070088041-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-04-19 US disclosed
EP-1753743-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS Sanofi-Aventis Deutschland GmbH (DE) 2007-02-21 EP disclosed
WO-2005111018-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-11-24 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-20070088041-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND THEIR USE AS PHARMACEUTICALS GSK3B, GSK3A, PDXK ALDH1A1 2673/4885HPGD 800/4885HTT 4003/4885

“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.