SCHEMBL7098294

SCHEMBL7098294

O=S(=O)(CCCCCCN1CCN(C(c2ccccc2)c2cc(F)ccn2)CC1)NC1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 6/20 0.42
▸ DRD3 P35462 6/20 0.42
▸ P2RX7 Q99572 7/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ DRD4 P21917 2/20 0.39
▸ ADRA1B P35368 1/20 0.38
▸ CHRM3 P20309 1/20 0.38

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
SCHEMBL7098292 0.87 DRD2 (0.42) DRD2DRD3DRD4ADRA1B
SCHEMBL7103907 0.86 DRD2 (0.42) DRD2DRD3P2RX7ALDH1A1MAPT
SCHEMBL7773719 0.83 P2RX7 (0.47) DRD2DRD3P2RX7ALDH1A1MAPT
SCHEMBL7775644 0.81 P2RX7 (0.45) DRD2DRD3P2RX7ALDH1A1MAPT
SCHEMBL7103905 0.78 DRD2 (0.45) DRD2DRD3
SCHEMBL7100671 0.78 ACHE (0.51) DRD2DRD3P2RX7ALDH1A1MAPT
SCHEMBL7103672 0.76 DRD3 (0.57) DRD2DRD3DRD4
SCHEMBL7099285 0.76 DRD3 (0.57) DRD2DRD3DRD4
SCHEMBL7097660 0.76 DRD3 (0.57) DRD2DRD3DRD4
SCHEMBL7097625 0.76 DRD3 (0.57) DRD2DRD3DRD4

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-1020443-B1 PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF AZWELL INC (JP) 2003-09-10 — — EP disclosed
US-6172228-B1 Process for producing piperazinesulfonamide derivatives and salts thereof AZWELL INC. (JP) 2001-01-09 — — US disclosed
EP-1020443-A1 PROCESS FOR PRODUCING PIPERAZINESULFONAMIDE DERIVATIVES AND SALTS THEREOF Azwell Inc. (JP) 2000-07-19 — — EP disclosed
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