SCHEMBL9527290

SCHEMBL9527290

Cn1ncc(Cl)c(NCCN2CCN(c3cccc(Cl)c3)CC2)c1=O

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.51
MAPK1 P28482 1/20 0.50
BPTF Q12830 1/20 0.50
MAPT P10636 2/20 0.48
HRH1 P35367 1/20 0.48
KMT2A Q03164 1/20 0.47
DRD2 P14416 1/20 0.47
DRD4 P21917 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
SCHEMBL9527024 0.90 BPTF (0.53) BPTFHRH1KMT2ADRD2
SCHEMBL9531418 0.90 KCNH2 (0.53) KCNH2MAPTHRH1DRD2DRD4
SCHEMBL9529009 0.89 BPTF (0.54) MAPK1BPTFHRH1DRD2DRD4
SCHEMBL9526907 0.88 HTR7 (0.49) DRD2
SCHEMBL9527765 0.85 KMT2A (0.53) KCNH2BPTFMAPTHRH1KMT2A
SCHEMBL9527111 0.84 BPTF (0.51) BPTFHRH1
SCHEMBL9529694 0.84 DRD2 (0.54) BPTFMAPTHRH1DRD2DRD4
SCHEMBL9531700 0.83 BPTF (0.46) BPTFMAPTHRH1KMT2ADRD2
SCHEMBL9531556 0.81 ADRA1A (0.53) BPTFDRD2
SCHEMBL9527274 0.81 BPTF (0.47) MAPK1BPTFMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0372305-B1 PIPERAZINYLALKYL-3(2H)-PYRIDAZINONES, METHOD FOR THEIR PREPARATION AND THEIR USE AS ANTIHYPERTENSIVE AGENTS Hafslund Nycomed Pharma Aktiengesellschaft (AT) 1993-08-04 EP disclosed
US-5034391-A Piperazinylalkyl-3(2H)-pyridazinones and the use thereof as agents lowering blood pressure CL PHARMA AKTIENGESELLSCHAFT (AT) 1991-07-23 US disclosed
EP-0372305-A1 Piperazinylalkyl-3(2H)-pyridazinones, method for their preparation and their use as antihypertensive agents Hafslund Nycomed Pharma Aktiengesellschaft (AT) 1990-06-13 EP disclosed