SCHEMBL9526907

SCHEMBL9526907

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

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 4/20 0.49
DRD2 P14416 7/20 0.48
DRD3 P35462 7/20 0.48
ADRA1A P35348 5/20 0.48
ALDH1A1 P00352 1/20 0.48
SIGMAR1 Q99720 1/20 0.47
DRD5 P21918 2/20 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
SCHEMBL9526832 0.90 HTR7 (0.47) HTR7DRD2DRD3ADRA1AALDH1A1
SCHEMBL9527290 0.88 KCNH2 (0.51) DRD2
SCHEMBL9527623 0.87 HTR7 (0.49) HTR7DRD2DRD3ADRA1AALDH1A1
SCHEMBL9531700 0.86 BPTF (0.46) DRD2ADRA1A
SCHEMBL9527024 0.85 BPTF (0.53) HTR7DRD2DRD3ADRA1ASIGMAR1
SCHEMBL9531418 0.85 KCNH2 (0.53) HTR7DRD2DRD3ADRA1AALDH1A1
SCHEMBL9527102 0.84 DRD2 (0.50) HTR7DRD2DRD3ADRA1ASIGMAR1
SCHEMBL9529009 0.82 BPTF (0.54) DRD2ADRA1A
SCHEMBL9527138 0.82 ATM (0.54) HTR7DRD2DRD3ADRA1AALDH1A1
SCHEMBL9529694 0.81 DRD2 (0.54) DRD2DRD3ADRA1ASIGMAR1DRD5

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 2 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
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