SCHEMBL5926141

SCHEMBL5926141

O=c1cc(NCCN2CCN(c3cccc(Cl)c3)CC2)cn[nH]1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 2/20 0.53
▸ MAPT P10636 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ SIGMAR1 Q99720 1/20 0.49
▸ HTR1A P08908 3/20 0.48
▸ DRD2 P14416 2/20 0.48
▸ HTR2A P28223 2/20 0.48
▸ HTR7 P34969 2/20 0.48
▸ HTR6 P50406 2/20 0.48
▸ PKM P14618 1/20 0.48
▸ RPS6KB1 P23443 1/20 0.48
▸ ADRA2A P08913 1/20 0.48
▸ CHRM1 P11229 1/20 0.48
▸ DRD1 P21728 1/20 0.48
▸ SLC6A4 P31645 1/20 0.48
▸ ADRA1A P35348 1/20 0.48
▸ OPRM1 P35372 1/20 0.48
▸ DRD3 P35462 1/20 0.48
▸ SLC6A3 Q01959 1/20 0.48
▸ USP2 O75604 1/20 0.48

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
SCHEMBL5926097 0.89 HTR7 (0.56) KCNH2MAPTHTR1ADRD2HTR2A
SCHEMBL27263980 0.86 DRD2 (0.54) KCNH2SIGMAR1HTR1ADRD2HTR2A
SCHEMBL5926252 0.83 HTR2A (0.53) MAPTHTR1ADRD2HTR2AHTR7
SCHEMBL5926085 0.79 PIM1 (0.47) HTR1ADRD2HTR2ADRD3
SCHEMBL5926325 0.79 DRD2 (0.48) MAPTKMT2AHTR1ADRD2HTR2A
SCHEMBL5926121 0.78 HTR1A (0.46) KCNH2KMT2AHTR1ADRD2HTR2A
SCHEMBL5926079 0.75 HTR1A (0.54) HTR1AADRA1A
SCHEMBL5926075 0.75 HTR1A (0.47) MAPTHTR1ADRD2ADRA2ASLC6A4
SCHEMBL5926110 0.74 HTR1A (0.38) HTR1ADRD2ADRA1A
Hydrochloric Acid SCHEMBL5926077 0.74 HTR1A (0.47) MAPTHTR1ADRD2ADRA2ASLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060211703-A1 Substituted alkyl-pyridazinones for the treatment of memory and learning malfunctions EGIS GYOGYSZERGYAR RT. (HU) 2006-09-21 — — US claimed
EP-1567159-A1 SUBSTITUTED ALKYL-PYRIDAZINONES FOR THE TREATMENT OF MEMORY AND LEARNING MALFUNCTIONS EGIS GYOGYSZERGYAR RT. (HU) 2005-08-31 — — EP claimed
US-20050043314-A1 Substituted alkylaminopyridazinone derivatives, process for the preparation thereof and pharmaceutical composition containing the same EGIS GYOGYSZERGYAR RT. (HU) 2005-02-24 — — US claimed
EP-1430034-B1 SUBSTITUTED ALKYLAMINOPYRIDAZINONE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME EGYT GYOGYSZERVEGYESZETI GYAR (HU) 2005-02-09 — — EP claimed
EP-1430034-A1 SUBSTITUTED ALKYLAMINOPYRIDAZINONE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME Egis Gyogyszergyar Rt. (HU) 2004-06-23 — — EP claimed
WO-2004043465-A1 SUBSTITUTED ALKYL-PYRIDAZINONES FOR THE TREATMENT OF MEMORY AND LEARNING MALFUNCTIONS EGIS Gyógyszergyár Rt. (HU) 2004-05-27 — — WO claimed
WO-2003027078-A1 SUBSTITUTED ALKYLAMINOPYRIDAZINONE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME EGIS Gyógyszergyár Rt. (HU) 2003-04-03 — — WO claimed
US-20060211703-A1 Substituted alkyl-pyridazinones for the treatment of memory and learning malfunctions EGIS GYOGYSZERGYAR RT. (HU) 2006-09-21 — — US disclosed
EP-1567159-A1 SUBSTITUTED ALKYL-PYRIDAZINONES FOR THE TREATMENT OF MEMORY AND LEARNING MALFUNCTIONS EGIS GYOGYSZERGYAR RT. (HU) 2005-08-31 — — EP disclosed
US-20050043314-A1 Substituted alkylaminopyridazinone derivatives, process for the preparation thereof and pharmaceutical composition containing the same EGIS GYOGYSZERGYAR RT. (HU) 2005-02-24 — — US disclosed
EP-1430034-B1 SUBSTITUTED ALKYLAMINOPYRIDAZINONE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME EGYT GYOGYSZERVEGYESZETI GYAR (HU) 2005-02-09 — — EP disclosed
EP-1430034-A1 SUBSTITUTED ALKYLAMINOPYRIDAZINONE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME Egis Gyogyszergyar Rt. (HU) 2004-06-23 — — EP disclosed
WO-2004043465-A1 SUBSTITUTED ALKYL-PYRIDAZINONES FOR THE TREATMENT OF MEMORY AND LEARNING MALFUNCTIONS EGIS Gyógyszergyár Rt. (HU) 2004-05-27 — — WO disclosed
WO-2003027078-A1 SUBSTITUTED ALKYLAMINOPYRIDAZINONE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME EGIS Gyógyszergyár Rt. (HU) 2003-04-03 — — 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-20050043314-A1 Substituted alkylaminopyridazinone derivatives, process for the preparation thereof and pharmaceutical composition containing the same CYP2C19, CYP2D6, CYP3A5 KCNH2 179/4885MAPT 3150/4885KMT2A 1770/4885
US-20060211703-A1 Substituted alkyl-pyridazinones for the treatment of memory and learning malfunctions CHRM1, CHRM2, CHRM5 KCNH2 113/4885MAPT 1225/4885KMT2A 248/4885

“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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