SCHEMBL5677305

SCHEMBL5677305

COc1ccccc1C=NNc1ccc(C2=NNC(=O)CC2C)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.61
▸ MAPT P10636 1/20 0.61
▸ PDE3B Q13370 15/20 0.54
▸ PDE3A Q14432 15/20 0.54
▸ PDE4A P27815 3/20 0.54
▸ PDE4B Q07343 3/20 0.54
▸ PDE4C Q08493 3/20 0.54
▸ PDE4D Q08499 3/20 0.54
▸ TNNC1 P63316 1/20 0.53
▸ GPR119 Q8TDV5 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL5677301 1.00 SMN1; SMN2 (0.61) SMN1; SMN2MAPTPDE3BPDE3APDE4A
SCHEMBL5678860 0.91 MAPT (0.57) SMN1; SMN2MAPTPDE3BPDE3APDE4A
SCHEMBL5678858 0.91 MAPT (0.57) SMN1; SMN2MAPTPDE3BPDE3APDE4A
SCHEMBL5677238 0.86 PDE3B (0.58) SMN1; SMN2MAPTPDE3BPDE3APDE4A
SCHEMBL5677243 0.86 PDE3B (0.58) SMN1; SMN2MAPTPDE3BPDE3APDE4A
SCHEMBL5678962 0.83 PDE3B (0.61) SMN1; SMN2MAPTPDE3BPDE3APDE4A
SCHEMBL5681201 0.83 PDE3B (0.55) SMN1; SMN2MAPTPDE3BPDE3APDE4A
SCHEMBL5678959 0.83 PDE3B (0.61) SMN1; SMN2MAPTPDE3BPDE3APDE4A
SCHEMBL5681590 0.82 MAPT (0.53) SMN1; SMN2MAPTPDE3BPDE3ATNNC1
SCHEMBL5681587 0.82 MAPT (0.53) SMN1; SMN2MAPTPDE3BPDE3ATNNC1

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 SMN1; SMN2 3452/4885MAPT 4871/4885PDE3B 1154/4885

“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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