SCHEMBL5677347

SCHEMBL5677347

CC1CC(=O)NN=C1c1ccc(N/N=C/c2cc([N+](=O)[O-])ccc2O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.52
▸ MEN1 O00255 8/20 0.52
▸ KMT2A Q03164 8/20 0.52
▸ NPC1 O15118 6/20 0.52
▸ MAPK1 P28482 2/20 0.52
▸ POLB P06746 1/20 0.52
▸ PDE3B Q13370 7/20 0.51
▸ PDE3A Q14432 7/20 0.51
▸ TNNC1 P63316 1/20 0.51
▸ GALR3 O60755 3/20 0.49
▸ THRB P10828 1/20 0.49
▸ KDM4E B2RXH2 5/20 0.48
▸ GAA P10253 4/20 0.48
▸ L3MBTL1 Q9Y468 4/20 0.48
▸ CCR6 P51684 1/20 0.48
▸ SMN1; SMN2 Q16637 5/20 0.47
▸ RAB9A P51151 4/20 0.47
▸ HTT P42858 4/20 0.47
▸ XBP1 P17861 1/20 0.47
▸ CASP3 P42574 1/20 0.47

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
SCHEMBL5677353 1.00 MAPT (0.52) MAPTMEN1KMT2ANPC1MAPK1
SCHEMBL5678906 0.88 MAPT (0.55) MAPTKMT2AMAPK1PDE3BPDE3A
SCHEMBL5678902 0.88 MAPT (0.55) MAPTKMT2AMAPK1PDE3BPDE3A
SCHEMBL27494992 0.88 MAPT (0.52) MAPTMEN1KMT2ANPC1MAPK1
SCHEMBL5678987 0.87 PDE3B (0.56) MAPTMAPK1PDE3BPDE3ATNNC1
SCHEMBL5678983 0.87 PDE3B (0.56) MAPTMAPK1PDE3BPDE3ATNNC1
SCHEMBL5679134 0.86 PDE3B (0.52) MAPTMEN1KMT2AMAPK1POLB
SCHEMBL5679128 0.86 PDE3B (0.52) MAPTMEN1KMT2AMAPK1POLB
SCHEMBL5680478 0.85 PDE3B (0.54) MAPTMEN1KMT2ANPC1MAPK1
SCHEMBL5680473 0.85 PDE3B (0.54) MAPTMEN1KMT2ANPC1MAPK1

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-1265871-B1 PYRIDAZINYL PHENYL HYDRAZONES USEFUL AGAINST CONGESTIVE HEART FAILURE ORION CORP (FI) 2006-02-08 — — EP disclosed
US-6699868-B2 INCREASE THE CALCIUM SENSITIVITY OF CONTRACTILE PROTEINS OF THE CARDIAC MUSCLE ORION CORPORATION (FI) 2004-03-02 — — US disclosed
US-20030158200-A1 Pyridazinyl phenyl hydrazones useful against congestive heart failure ORION CORPORATION (FI) 2003-08-21 — — US disclosed
EP-1265871-A1 PYRIDAZINYL PHENYL HYDRAZONES USEFUL AGAINST CONGESTIVE HEART FAILURE ORION CORPORATION (FI) 2002-12-18 — — EP disclosed
WO-2001068611-A1 PYRIDAZINYL PHENYL HYDRAZONES USEFUL AGAINST CONGESTIVE HEART FAILURE ORION CORPORATION (FI) 2001-09-20 — — 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-20030158200-A1 Pyridazinyl phenyl hydrazones useful against congestive heart failure FABP3, TNNI3, TNNT2 MAPT 4871/4885MEN1 4874/4885KMT2A 4528/4885

“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.

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