SCHEMBL2497675

SCHEMBL2497675

CN(C)C=CC(=O)c1nn(-c2cccc(Br)c2)ccc1=O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
POLB P06746 1/20 0.45
CYP2C9 P11712 1/20 0.44
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
LMNA P02545 2/20 0.40
RAB9A P51151 2/20 0.40
RECQL P46063 1/20 0.40
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
MAPT P10636 3/20 0.39
NPC1 O15118 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
HTT P42858 1/20 0.38

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
SCHEMBL2497671 1.00 MEN1 (0.49) MEN1KMT2APOLBCYP2C9GAA
SCHEMBL519061 0.87 KMT2A (0.50) MEN1KMT2APOLBCYP2C9GAA
SCHEMBL7907401 0.87 KMT2A (0.50) MEN1KMT2APOLBCYP2C9GAA
SCHEMBL519036 0.87 POLB (0.60) MEN1KMT2APOLBCYP2C9GAA
SCHEMBL518693 0.87 KMT2A (0.66) MEN1KMT2APOLBCYP2C9GAA
SCHEMBL518692 0.87 KMT2A (0.66) MEN1KMT2APOLBCYP2C9GAA
SCHEMBL519060 0.87 KMT2A (0.50) MEN1KMT2APOLBCYP2C9GAA
SCHEMBL519035 0.87 POLB (0.60) MEN1KMT2APOLBCYP2C9GAA
SCHEMBL519706 0.86 KMT2A (0.49) MEN1KMT2APOLBCYP2C9GAA
SCHEMBL519707 0.86 KMT2A (0.49) MEN1KMT2APOLBCYP2C9GAA

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-2373641-B1 PYRIDAZINONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2012-12-19 EP disclosed
US-8178538-B2 Pyridazinones HOFFMANN-LA ROCHE INC. (US) 2012-05-15 US disclosed
EP-2373641-A1 PYRIDAZINONE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2011-10-12 EP disclosed
US-20100152193-A1 PYRIDAZINONES HOFFMANN-LA ROCHE, INC. 2010-06-17 US disclosed
WO-2010063610-A1 PYRIDAZINONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2010-06-10 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-20100152193-A1 PYRIDAZINONES PDE5A, PDE3A, PDE10A MEN1 1741/4885KMT2A 2667/4885POLB 2581/4885

“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.